Substrate
/
Generation 1
XenoSite
Paracetamol
CC(=O)Nc1ccc(O)cc1
CHEBI
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Description
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
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Generation 1
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Hydroquinone
Oc1ccc(O)cc1
CHEBI
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Description
▾
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.
hydroxylation
Probability 0.06
0.06
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Hydroxyhydroquinone
dehydrogenation
Probability 0.05
0.05
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Benzoquinone
epoxidation
Probability 0.01
0.01
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epoxidation
Probability 0.01
0.01
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dealkylation
Probability 0.00
0.00
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Showing 5 of 15 metabolites
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