Substrate
/
Generation 1
XenoSite
Anisotanol c
C=C(CO)C1CC2C3CC(O)C(O)C(C)C23C1
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
Show metabolites
CC1C(O)C(O)CC2C3CC(C4(CO)CO4)CC123
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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 0.25
0.25
dealkylation
Probability 0.25
0.25
dealkylation
Probability 0.25
0.25
Methanol
dealkylation
Probability 0.25
0.25
Formic acid
dealkylation
Probability 0.25
0.25
Methandiol