Substrate
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Generation 1
XenoSite
Acetochlor
CCOCN(C(=O)CCl)c1c(C)cccc1CC
CHEBI
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Description
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
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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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CCc1cccc(C)c1N(CO)C(=O)CCl
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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 2
Select a metabolite to form the next generation.
dealkylation
Probability 0.65
0.65
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Formaldehyde
dealkylation
Probability 0.65
0.65
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<em>n</em>-(2-ethyl-6-methylphenyl)-2-chloroacetamide
dealkylation
Probability 0.65
0.65
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Carbonic acid
dealkylation
Probability 0.65
0.65
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Formic acid
dealkylation
Probability 0.65
0.65
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Methandiol
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