Substrate
/
Generation 1
/
Generation 2
XenoSite
Asn-trp
NC(=O)CC(N)C(=O)NC(Cc1c[nH]c2ccccc12)C(=O)O
CHEBI
Copy JSON
Description
▾
Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 1
Show metabolites
NC(=O)CC(N)C(=O)NC(CC1=CN=C2C(=O)C=CC=C12)C(=O)O
Copy JSON
Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 2
Show metabolites
NC(CC1=CN=C2C(=O)C=CC=C12)C(=O)O
Copy JSON
Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
stable oxygenation
unstable oxygenation
dehydrogenation
reduction
hydrolysis
Generation 3
Select a metabolite to form the next generation.
dehydration
Probability 0.38
0.38
dehydration
Probability 0.38
0.38
15o
hydrogenation
Probability 0.38
0.38
oxygen reduction
Probability 0.38
0.38