Azocarmine g free acid

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

Azocarmine g free acid Epoxidation prediction

Generation 1

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

O=S(=O)(O)c1ccc(N=c2cc3n(-c4ccccc4)c4c(nc-3c3ccc(S(=O)(=O)O)cc23)=CC2OC2C=4)cc1 Quinonation prediction

Generation 2

quinone formation · 0.00

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

O=C1C=CC=CC1=[n+]1c2c(nc3c1=CC1OC1C=3)-c1ccc(S(=O)(=O)O)cc1C(=Nc1ccc(S(=O)(=O)O)cc1)C=2