Substrate
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Generation 1
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Generation 2
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Generation 3
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Generation 4
XenoSite
Antinonnin
Cc1cc([N+](=O)[O-])cc([N+](=O)[O-])c1O
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 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
Cc1cc(N)cc(O)c1O
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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
CC1=C(O)C2(O)OC2C(N)=C1
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
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Show metabolites
CC1=CC(N)=C2OC2(O)C1=O
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
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Generation 5
Maximum generation reached — metabolites here can't start another hop.
n dealkylation
Probability 0.07
0.07
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n dealkylation
Probability 0.07
0.07
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((sup 13)n)ammonia
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