Substrate
/
Generation 1
/
Generation 2
XenoSite
Azanigerone f
CC(=O)OC1(C)C(=O)C=C2C=C(CC(C)O)OC=C2C1=O
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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CC(=O)OC1(C)C(=O)C2=COC(CC(C)O)=CC23OC3C1=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
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CC(=O)OC1(C)C(=O)C2=COC(CC(C)O)=CC23OC3C1O
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
gsh
protein
cyanide
dna
Generation 3
Select a metabolite to form the next generation.
protein
Probability 0.22
0.22
glutathionation
Probability 0.17
0.17
glutathionation
Probability 0.07
0.07
dna
Probability 0.04
0.04
dna
Probability 0.03
0.03
Showing 5 of 12 metabolites
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