Angenomalin

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

Angenomalin Epoxidation prediction

Generation 1

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

C=C(C)C1CC2=c3oc(=O)ccc3=CC3OC23O1 stable oxygenation prediction

C=C(C)C1CC2=c3oc(=O)ccc3=CC3OC23O1 unstable oxygenation prediction

C=C(C)C1CC2=c3oc(=O)ccc3=CC3OC23O1 dehydrogenation prediction

C=C(C)C1CC2=c3oc(=O)ccc3=CC3OC23O1 reduction prediction

C=C(C)C1CC2=c3oc(=O)ccc3=CC3OC23O1 hydrolysis prediction

Generation 2

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

CC1(C2CC3=c4oc(=O)ccc4=CC4OC34O2)CO1 gsh prediction

CC1(C2CC3=c4oc(=O)ccc4=CC4OC34O2)CO1 protein prediction

CC1(C2CC3=c4oc(=O)ccc4=CC4OC34O2)CO1 cyanide prediction

CC1(C2CC3=c4oc(=O)ccc4=CC4OC34O2)CO1 dna prediction

Generation 3

Select a metabolite to form the next generation.

Showing 5 of 20 metabolites