Auricin

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

Auricin Quinonation prediction

Generation 1

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

CC1CC(=O)C(OC2CCC(N(C)C)C(C)O2)C2(O1)OC1CC(=O)OC1c1c2c(=O)c2c(=O)ccc(=O)c=2c1=O stable oxygenation prediction

CC1CC(=O)C(OC2CCC(N(C)C)C(C)O2)C2(O1)OC1CC(=O)OC1c1c2c(=O)c2c(=O)ccc(=O)c=2c1=O unstable oxygenation prediction

CC1CC(=O)C(OC2CCC(N(C)C)C(C)O2)C2(O1)OC1CC(=O)OC1c1c2c(=O)c2c(=O)ccc(=O)c=2c1=O dehydrogenation prediction

CC1CC(=O)C(OC2CCC(N(C)C)C(C)O2)C2(O1)OC1CC(=O)OC1c1c2c(=O)c2c(=O)ccc(=O)c=2c1=O reduction prediction

CC1CC(=O)C(OC2CCC(N(C)C)C(C)O2)C2(O1)OC1CC(=O)OC1c1c2c(=O)c2c(=O)ccc(=O)c=2c1=O hydrolysis prediction

Generation 2

Select a metabolite to form the next generation.

Showing 5 of 143 metabolites