Substrate
/
Generation 1
/
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)C1=C(C)C2OC2C=C1CC
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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
CCOCNC1=C(C)C2OC2C=C1CC
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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 0.54
0.54
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dealkylation
Probability 0.54
0.54
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Ethyl carbonate
dealkylation
Probability 0.54
0.54
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Ethyl formate
dealkylation
Probability 0.54
0.54
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dealkylation
Probability 0.46
0.46
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(11c)acetic acid
Showing 5 of 62 metabolites
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