Antinonnin

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

Antinonnin N-Dealkylation prediction

Generation 1

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

Cc1cc(O)cc([N+](=O)[O-])c1O stable oxygenation prediction

Cc1cc(O)cc([N+](=O)[O-])c1O unstable oxygenation prediction

Cc1cc(O)cc([N+](=O)[O-])c1O dehydrogenation prediction

Cc1cc(O)cc([N+](=O)[O-])c1O reduction prediction

Cc1cc(O)cc([N+](=O)[O-])c1O hydrolysis prediction

Generation 2

hydrogenation · 0.18

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

Cc1cc(O)cc([NH+]([O-])O)c1O