Substrate
/
Generation 1
/
Generation 2
XenoSite
Amfepramonum
CCN(CC)C(C)C(=O)c1ccccc1
CHEBI
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Description
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
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Generation 1
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CCN(CC)C(C)C(=O)C12C=CC=CC1O2
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
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Generation 2
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An oxidized polyvinyl alcohol
CC=O
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 3
Select a metabolite to form the next generation.
dehydration
Probability 0.66
0.66
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Ethane
dehydration
Probability 0.66
0.66
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15o
hydrogenation
Probability 0.66
0.66
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A polyvinyl alcohol
oxygen reduction
Probability 0.66
0.66
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A polyvinyl alcohol
hydroxylation
Probability 0.13
0.13
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Glycolaldehyde
Showing 5 of 9 metabolites
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