Substrate
/
Generation 1
XenoSite
Adipic monoaldehyde
O=CCCCCC(=O)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 1
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Valeric acid
CCCCC(=O)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 2
Select a metabolite to form the next generation.
hydroxylation
Probability 0.14
0.14
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4-oxy-butan-carbonsäure
hydroxylation
Probability 0.10
0.10
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Laevulinic acid
hydroxylation
Probability 0.10
0.10
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4-hydroxy-valeric acid
dealkylation
Probability 0.07
0.07
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(11c)acetic acid
dealkylation
Probability 0.07
0.07
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Propane
Showing 5 of 44 metabolites
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