Substrate
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Generation 1
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Generation 2
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Generation 3
XenoSite
Angenomalin
C=C(C)C1Cc2c(ccc3ccc(=O)oc23)O1
CHEBI
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Description
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
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Generation 1
Show metabolites
CC1(C2Cc3c(ccc4ccc(=O)oc34)O2)CO1
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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 2
Show metabolites
CC(O)(C(=O)O)C1Cc2c(ccc3ccc(=O)oc23)O1
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 3
Show metabolites
CC(O)(C(=O)O)C1Cc2c(ccc3c2OC(=O)C(=O)C3=O)O1
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 4
Select a metabolite to form the next generation.
glucuronidation
Probability 0.71
0.71
glucuronidation
Probability 0.11
0.11