Substrate
/
Generation 1
/
Generation 2
XenoSite
Acetylcaranine
CC(=O)OC1CC=C2CCN3Cc4cc5c(cc4C1C23)OCO5
CHEBI
Copy JSON
Description
▾
Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 1
Show metabolites
CC(=O)OC1CC=C(CCO)C2NCc3cc4c(cc3C12)OCO4
Copy JSON
Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 2
Show metabolites
CC(=O)OC1CC=C(CCO)C2NCC3=CC45OCOC4(C=C3C12)O5
Copy JSON
Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
gsh
protein
cyanide
dna
Generation 3
Select a metabolite to form the next generation.
glutathionation
Probability 0.19
0.19
glutathionation
Probability 0.14
0.14
protein
Probability 0.13
0.13
dna
Probability 0.08
0.08
protein
Probability 0.07
0.07
Showing 5 of 8 metabolites
Show all