Substrate
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Generation 1
XenoSite
Acetylated methyl ferulate
COC(=O)C=Cc1ccc(OC(C)=O)c(OC)c1
CHEBI
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Description
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
stable oxygenation
unstable oxygenation
dehydrogenation
reduction
hydrolysis
Generation 1
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Methyl ferulate
COC(=O)C=Cc1ccc(O)c(OC)c1
CHEBI
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Description
▾
Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 2
Select a metabolite to form the next generation.
epoxidation
Probability 0.04
0.04
epoxidation
Probability 0.03
0.03
epoxidation
Probability 0.02
0.02
epoxidation
Probability 0.01
0.01
epoxidation
Probability 0.01
0.01
Showing 5 of 7 metabolites
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