Substrate
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Generation 1
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Generation 2
XenoSite
Asparaginylmethionine
CSCCC(NC(=O)C(N)CC(N)=O)C(=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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Generation 1
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2-keto-4-methylthiobutyric acid
CSCCC(=O)C(=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
Show metabolites
O=C(O)C(=O)CCS
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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.
sulfur oxidation
Probability 0.55
0.55
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sulfur oxidation
Probability 0.55
0.55
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sulfur oxidation
Probability 0.55
0.55
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hydrogenation
Probability 0.32
0.32
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hydrogenation
Probability 0.06
0.06
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Showing 5 of 32 metabolites
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