Substrate
/
Generation 1
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Generation 2
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
About this model
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Generation 1
Show metabolites
CCOCN(C(=O)CCl)C12OC1(C)C=CC=C2CC
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
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Generation 2
Show metabolites
Ethyl carbonate
CCOC(=O)O
CHEBI
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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.
dealkylation
Probability 0.14
0.14
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(11c)acetic acid
dealkylation
Probability 0.14
0.14
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An oxidized polyvinyl alcohol
dealkylation
Probability 0.14
0.14
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A polyvinyl alcohol
dealkylation
Probability 0.14
0.14
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Carbonic acid
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