Substrate
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Generation 1
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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
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Generation 1
Show metabolites
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
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Generation 2
Show metabolites
CC12C=CC(O)=C(O)C1O2
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
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stable oxygenation
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unstable oxygenation
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dehydrogenation
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reduction
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hydrolysis
Generation 3
Select a metabolite to form the next generation.
hydrogenation
Probability 0.31
0.31
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dealkylation
Probability 0.25
0.25
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Tennesine hydride
dealkylation
Probability 0.25
0.25
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Formaldehyde
dealkylation
Probability 0.25
0.25
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Methanol
dealkylation
Probability 0.25
0.25
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Showing 5 of 39 metabolites
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