Substrate
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Generation 1
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Generation 2
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Generation 3
XenoSite
Acecainidum
CCN(CC)CCNC(=O)c1ccc(NC(C)=O)cc1
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
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CCN(CC)CCNC(=O)C12C=CC(NC(C)=O)=CC1O2
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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
CCN(CC)CC=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 3
Show metabolites
Glyoxal
O=CC=O
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 4
Select a metabolite to form the next generation.
hydrogenation
Probability 0.59
0.59
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Glycolaldehyde
dealkylation
Probability 0.01
0.01
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Formaldehyde
dealkylation
Probability 0.01
0.01
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<small><sup>13</small></sup>co2
dealkylation
Probability 0.01
0.01
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Formic acid
hydroxylation
Probability 0.01
0.01
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Glyoxylic acid
Showing 5 of 8 metabolites
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