Adp-d-ribose

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

Adp-d-ribose Epoxidation prediction

Generation 1

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

NC12N=CN=C3N(C4OC(COP(=O)(O)OP(=O)(O)OC5OC(CO)C(O)C5O)C(O)C4O)C=NC31O2 N-Dealkylation prediction

Generation 2

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

N=CN=C1N(C2OC(COP(=O)(O)OP(=O)(O)OC3OC(CO)C(O)C3O)C(O)C2O)C=NC12OC2(N)O stable oxygenation prediction

N=CN=C1N(C2OC(COP(=O)(O)OP(=O)(O)OC3OC(CO)C(O)C3O)C(O)C2O)C=NC12OC2(N)O unstable oxygenation prediction

N=CN=C1N(C2OC(COP(=O)(O)OP(=O)(O)OC3OC(CO)C(O)C3O)C(O)C2O)C=NC12OC2(N)O dehydrogenation prediction

N=CN=C1N(C2OC(COP(=O)(O)OP(=O)(O)OC3OC(CO)C(O)C3O)C(O)C2O)C=NC12OC2(N)O reduction prediction

N=CN=C1N(C2OC(COP(=O)(O)OP(=O)(O)OC3OC(CO)C(O)C3O)C(O)C2O)C=NC12OC2(N)O hydrolysis prediction

Generation 3

Select a metabolite to form the next generation.

Showing 5 of 126 metabolites