Substrate
/
Generation 1
XenoSite
Alpha-ochratoxin
CC1Cc2c(Cl)cc(C(=O)O)c(O)c2C(=O)O1
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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CC(O)Cc1c(Cl)cc(C(=O)O)c(O)c1C=O
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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.
dehydration
Probability 0.09
0.09
dehydration
Probability 0.09
0.09
15o
hydrogenation
Probability 0.09
0.09
oxygen reduction
Probability 0.09
0.09
hydroxylation
Probability 0.04
0.04
Showing 5 of 83 metabolites
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