Substrate
/
Generation 1
XenoSite
Bauhinoxepin a
Cc1c(O)c2c(c3c1OC(C)(C)C=C3)C=Cc1c(O)cccc1O2
CHEBI
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Description
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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 1
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Cc1c(O)c2c(c3c1OC(C)(C)CC3)C=Cc1c(O)cccc1O2
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 2
Select a metabolite to form the next generation.
epoxidation
Probability 0.17
0.17
epoxidation
Probability 0.04
0.04
epoxidation
Probability 0.01
0.01
epoxidation
Probability 0.01
0.01
epoxidation
Probability 0.01
0.01
Showing 5 of 13 metabolites
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