Substrate
/
Generation 1
/
Generation 2
/
Generation 3
XenoSite
Benazeprilat
O=C(O)CN1C(=O)C(NC(CCc2ccccc2)C(=O)O)CCc2ccccc21
CHEBI
Copy JSON
Description
▾
Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 1
Show metabolites
O=C1C=CC2=[N+](CC(=O)O)C(=O)C(NC(CCc3ccccc3)C(=O)O)CCC2=C1
Copy JSON
Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 2
Show metabolites
NC1CCC2=CC(=O)C=CC2=[N+](CC(=O)O)C1=O
Copy JSON
Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 3
Show metabolites
NC1CCC2=CC(=O)C3OC3C2=[N+](CC(=O)O)C1=O
Copy JSON
Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
stable oxygenation
unstable oxygenation
dehydrogenation
reduction
hydrolysis
Generation 4
Select a metabolite to form the next generation.
dehydration
Probability 0.34
0.34
dehydration
Probability 0.34
0.34
15o
hydrogenation
Probability 0.34
0.34
oxygen reduction
Probability 0.34
0.34
hydrolysis
Probability 0.08
0.08
Showing 5 of 83 metabolites
Show all