Substrate
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Generation 1
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Generation 2
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Generation 3
XenoSite
Antinonnin
Cc1cc([N+](=O)[O-])cc([N+](=O)[O-])c1O
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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stable oxygenation
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unstable oxygenation
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dehydrogenation
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reduction
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hydrolysis
Generation 1
Show metabolites
Cc1cc(N)cc([N+](=O)[O-])c1O
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
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Generation 2
Show metabolites
CC12OC1C(N)=CC([N+](=O)[O-])=C2O
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
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Generation 3
Show metabolites
CC12OC1C(N)=CC(O)=C2O
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
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Generation 4
Select a metabolite to form the next generation.
glucuronidation
Probability 0.84
0.84
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glucuronidation
Probability 0.72
0.72
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