Achromobactin free acid

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

Achromobactin free acid stable oxygenation prediction

Achromobactin free acid unstable oxygenation prediction

Achromobactin free acid dehydrogenation prediction

Achromobactin free acid reduction prediction

Achromobactin free acid hydrolysis prediction

Generation 1

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

O=C(O)CC(O)(CC(=O)OCCN1C(=O)CCC1(O)C(=O)O)C(=O)O N-Dealkylation prediction

Generation 2

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

O=C1CCC(O)(C(=O)O)N1 UGT Conjugation prediction

Generation 3

Select a metabolite to form the next generation.