Substrate
Generation 1

Acetic acid oleyl ester

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

Acetic acid oleyl ester stable oxygenation prediction

Acetic acid oleyl ester unstable oxygenation prediction

Acetic acid oleyl ester dehydrogenation prediction

Acetic acid oleyl ester reduction prediction

Acetic acid oleyl ester hydrolysis prediction

Generation 1

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

CC(=O)CCCCCCC=CCCCCCCCCOC(C)=O Quinonation prediction