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 stable oxygenation prediction

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

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

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

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

Generation 2

(11c)acetic acid

hydrolysis · 0.55

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

(11c)acetic acid