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)c1ccc2c3nc4ccccc4n(-c4ccccc4)c-3cc(=NC3=CC4OC4(S(=O)(=O)O)C=C3)c2c1 Quinonation prediction

Generation 2

quinone formation · 0.00

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

O=C1C=c2nc3c4ccc(S(=O)(=O)O)cc4c(=NC4=CC5OC5(S(=O)(=O)O)C=C4)cc-3n(-c3ccccc3)c2=CC1=O