Substrate
/
Generation 1
/
Generation 2
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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Generation 1
Show metabolites
O=c1cccc2ccc3ccccc3nc1-2
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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
Show metabolites
OC1C=CC=C2C=Cc3ccccc3N=C21
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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 3
Select a metabolite to form the next generation.
hydrogenation
Probability 0.25
0.25
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epoxidation
Probability 0.19
0.19
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hydroxylation
Probability 0.14
0.14
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hydroxylation
Probability 0.12
0.12
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hydroxylation
Probability 0.12
0.12
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Showing 5 of 107 metabolites
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