Agaritine zwitterion

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

Agaritine zwitterion Quinonation prediction

Generation 1

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

[NH3+]C(CCC(=O)NNC1=CC=C(CO)C(=O)C1=O)C(=O)[O-] stable oxygenation prediction

[NH3+]C(CCC(=O)NNC1=CC=C(CO)C(=O)C1=O)C(=O)[O-] unstable oxygenation prediction

[NH3+]C(CCC(=O)NNC1=CC=C(CO)C(=O)C1=O)C(=O)[O-] dehydrogenation prediction

[NH3+]C(CCC(=O)NNC1=CC=C(CO)C(=O)C1=O)C(=O)[O-] reduction prediction

[NH3+]C(CCC(=O)NNC1=CC=C(CO)C(=O)C1=O)C(=O)[O-] hydrolysis prediction

Generation 2

Select a metabolite to form the next generation.

Showing 5 of 81 metabolites