Substrate
/
Generation 1
/
Generation 2
XenoSite
Acetylcaranine
CC(=O)OC1CC=C2CCN3Cc4cc5c(cc4C1C23)OCO5
CHEBI
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Description
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 1
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COC1=CC2=C(CN3CCC4=CCC(OC(C)=O)C2C43)C(=O)C1=O
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 2
Show metabolites
COC1=CC(C2C(OC(C)=O)CC=C3CCNC32)=C(C=O)C(=O)C1=O
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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 0.41
0.41
protein
Probability 0.18
0.18
protein
Probability 0.16
0.16
dna
Probability 0.08
0.08
dna
Probability 0.05
0.05
Showing 5 of 8 metabolites
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