Substrate
/
Generation 1
XenoSite
Carbamazepine
NC(=O)N1c2ccccc2C=Cc2ccccc21
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
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NC(=O)N(c1ccccc1)c1ccccc1C=C=O
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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.
hydrogenation
Probability 0.45
0.45
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hydroxylation
Probability 0.28
0.28
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hydroxylation
Probability 0.11
0.11
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hydrolysis
Probability 0.11
0.11
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Carbamic acid
hydrolysis
Probability 0.11
0.11
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Formamide
Showing 5 of 61 metabolites
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