Substrate
/
Generation 1
XenoSite
Alclofenac
C=CCOc1ccc(CC(=O)O)cc1Cl
CHEBI
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Description
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
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Generation 1
Show metabolites
O=C(O)Cc1ccc(OCC2CO2)c(Cl)c1
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
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stable oxygenation
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unstable oxygenation
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dehydrogenation
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reduction
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hydrolysis
Generation 2
Select a metabolite to form the next generation.
dealkylation
Probability 0.29
0.29
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dealkylation
Probability 0.29
0.29
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3-chloro-4-hydroxybenzeneacetic acid
dealkylation
Probability 0.29
0.29
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2-oxiranecarboxaldehyde
dealkylation
Probability 0.29
0.29
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(<i>s</i>)-(−)-2,3-epoxy-1-propanol
dealkylation
Probability 0.15
0.15
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Showing 5 of 90 metabolites
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