Substrate
/
Generation 1
/
Generation 2
XenoSite
Aspermutarubrol
Cc1cc(O)c(O)c(Oc2cc(C)cc(O)c2O)c1
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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Cc1cc(O)c(O)c(OC2=CC3(C)OC3C(O)=C2O)c1
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 2
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CC1=CC(O)=C(O)C(=O)C1=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 3
Select a metabolite to form the next generation.
dehydration
Probability 0.38
0.38
dehydration
Probability 0.38
0.38
15o
hydrogenation
Probability 0.38
0.38
oxygen reduction
Probability 0.38
0.38
dehydration
Probability 0.33
0.33
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