Substrate
/
Generation 1
XenoSite
Bcig
OCC1OC(Oc2c[nH]c3ccc(Br)c(Cl)c23)C(O)C(O)C1O
CHEBI
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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
OCC1OC(OC2=CNC34OC3C=C(Br)C(Cl)=C24)C(O)C(O)C1O
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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
Select a metabolite to form the next generation.
dealkylation
Probability 0.08
0.08
Formic acid
dealkylation
Probability 0.08
0.08
dealkylation
Probability 0.08
0.08
Methandiol
dehydrogenation
Probability 0.00
0.00