Substrate
/
Generation 1
XenoSite
Bcig
OCC1OC(Oc2c[nH]c3ccc(Br)c(Cl)c23)C(O)C(O)C1O
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Description
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 1
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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
oxidative dehalogenation
Probability 0.08
0.08
Acidum hydrochloricum
oxidative dehalogenation
Probability 0.08
0.08
Showing 5 of 91 metabolites
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