Substrate
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Generation 1
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Generation 2
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Generation 3
XenoSite
Aspergillusene b
Cc1c(CCC(C)C)oc2cc(C(=O)O)ccc12
CHEBI
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Description
▾
Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 1
Show metabolites
Cc1c2c(oc1=CCC(C)C)=CC(C(=O)O)=CC2=O
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 2
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CC1=C2C(=O)C=C(C(=O)O)C=C2OC12OC2CC(C)C
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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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CC1=C2C(=CC(C(=O)O)=CC2O)OC12OC2CC(C)C
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oxygen reduction · 0.30
Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation