Angenomalin

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

Angenomalin stable oxygenation prediction

Angenomalin unstable oxygenation prediction

Angenomalin dehydrogenation prediction

Angenomalin reduction prediction

Angenomalin hydrolysis prediction

Generation 1

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

C=C(CO)C1Cc2c(ccc3ccc(=O)oc23)O1 Epoxidation prediction

Generation 2

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

C=C(CO)C1CC23OC24OC(=O)C=CC4=CC=C3O1 gsh prediction

C=C(CO)C1CC23OC24OC(=O)C=CC4=CC=C3O1 protein prediction

C=C(CO)C1CC23OC24OC(=O)C=CC4=CC=C3O1 cyanide prediction

C=C(CO)C1CC23OC24OC(=O)C=CC4=CC=C3O1 dna prediction

Generation 3

Select a metabolite to form the next generation.