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
stable oxygenation
unstable oxygenation
dehydrogenation
reduction
hydrolysis
Generation 1
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<small>l</small>-galactono-1,5-lactone
O=C1OC(CO)C(O)C(O)C1O
CHEBI
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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.
hydrolysis
Probability 0.20
0.20
Isohexonic acid
hydrolysis
Probability 0.20
0.20
Demannose
dehydration
Probability 0.12
0.12
15o
dehydration
Probability 0.12
0.12
1,5-anhydrohexitol
hydrogenation
Probability 0.12
0.12
Hexopyranose
Showing 5 of 47 metabolites
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