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
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OCC1OC(OC23OC2Nc2ccc(Br)c(Cl)c23)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 0.27
0.27
dealkylation
Probability 0.27
0.27
Hexopyranose
dealkylation
Probability 0.18
0.18
dealkylation
Probability 0.18
0.18
dealkylation
Probability 0.09
0.09
Showing 5 of 94 metabolites
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