Substrate
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Generation 1
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Generation 2
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Generation 3
XenoSite
Ananolignan b
COc1cc2c(c(OC)c1OC)-c1c(cc3c(c1OC)OCO3)C(OC(C)=O)C(C)C(C)C2=O
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Description
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 1
Show metabolites
COC1=C(OC)C(=O)C2=C3C(=O)C4=C(C=C3C(OC(C)=O)C(C)C(C)C(=O)C2=C1)OCO4
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 2
Show metabolites
COC1=C(OC)C(=O)C2=C3C(=O)C4=C(OCO4)C4OC34C(OC(C)=O)C(C)C(C)C(=O)C2=C1
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
stable oxygenation
unstable oxygenation
dehydrogenation
reduction
hydrolysis
Generation 3
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An oxidized polyvinyl alcohol
CC=O
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Description
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hydrolysis · 0.43
Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation