Substrate
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Generation 1
XenoSite
Acetilcisteina
CC(=O)NC(CS)C(=O)O
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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Cysteine
NC(CS)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
Select a metabolite to form the next generation.
sulfur oxidation
Probability 0.49
0.49
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Cys-sulfenic acid
sulfur oxidation
Probability 0.49
0.49
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sulfur oxidation
Probability 0.49
0.49
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Cysteine sulfoxide
dealkylation
Probability 0.07
0.07
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Aminomalonic acid
dealkylation
Probability 0.07
0.07
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2-aminomalonate semialdehyde
Showing 5 of 41 metabolites
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