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)c4ccccc4nc-3c3c2C2OC2(S(=O)(=O)O)C=C3)cc1 Quinonation prediction

Generation 2

quinone formation · 0.00

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

O=C1C=CC(=NC2=CC(=Nc3ccc(S(=O)(=O)O)cc3)C3=C(C=CC4(S(=O)(=O)O)OC34)C2=Nc2ccccc2)C=C1