Acequinocyl

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

Acequinocyl Quinonation prediction

Generation 1

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

CCCCCCCCCCCCc1c(OC(C)=O)c(=O)c2c(=O)ccc(=O)c=2c1=O Epoxidation prediction

Generation 2

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

CCCCCCCCCCCCC12OC1(OC(C)=O)C(=O)C1=C(C(=O)C=CC1=O)C2=O gsh prediction

CCCCCCCCCCCCC12OC1(OC(C)=O)C(=O)C1=C(C(=O)C=CC1=O)C2=O protein prediction

CCCCCCCCCCCCC12OC1(OC(C)=O)C(=O)C1=C(C(=O)C=CC1=O)C2=O cyanide prediction

CCCCCCCCCCCCC12OC1(OC(C)=O)C(=O)C1=C(C(=O)C=CC1=O)C2=O dna prediction

Generation 3

glutathionation · 0.37

*C1C=C(O)C2=C(C1=O)C(=O)C1(OC(C)=O)OC1(CCCCCCCCCCCC)C2=O |$GSH;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|