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=C(O1)C1OC1c1ccc(=O)oc12 stable oxygenation prediction

C=C(C)C1CC2=C(O1)C1OC1c1ccc(=O)oc12 unstable oxygenation prediction

C=C(C)C1CC2=C(O1)C1OC1c1ccc(=O)oc12 dehydrogenation prediction

C=C(C)C1CC2=C(O1)C1OC1c1ccc(=O)oc12 reduction prediction

C=C(C)C1CC2=C(O1)C1OC1c1ccc(=O)oc12 hydrolysis prediction

Generation 2

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

CC(C)C1CC2=C(O1)C1OC1c1ccc(=O)oc12 gsh prediction

CC(C)C1CC2=C(O1)C1OC1c1ccc(=O)oc12 protein prediction

CC(C)C1CC2=C(O1)C1OC1c1ccc(=O)oc12 cyanide prediction

CC(C)C1CC2=C(O1)C1OC1c1ccc(=O)oc12 dna prediction

Generation 3

dna · 0.15

*C1C2=C(CC(C(C)C)O2)c2oc(=O)ccc2C1O |$DNA;;;;;;;;;;;;;;;;;;$|