Substrate
/
Generation 1
/
Generation 2
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(Oc2c[nH]c3c2C(Cl)=C(Br)C2OC32)C(O)C(O)C1O
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 2
Show metabolites
NC=C(OC1OC(CO)C(O)C(O)C1O)C1=C(O)C2OC2C(Br)=C1Cl
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 3
Select a metabolite to form the next generation.
epoxidation
Probability 0.33
0.33
epoxidation
Probability 0.11
0.11
epoxidation
Probability 0.06
0.06