Substrate
/
Generation 1
XenoSite
Ananolignan b
COc1cc2c(c(OC)c1OC)-c1c(cc3c(c1OC)OCO3)C(OC(C)=O)C(C)C(C)C2=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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COC1=C(OC)C2(OC)OC2C2=C1c1c(cc3c(c1OC)OCO3)C(OC(C)=O)C(C)C(C)C2=O
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
gsh
protein
cyanide
dna
Generation 2
Select a metabolite to form the next generation.
dna
Probability 0.16
0.16
glutathionation
Probability 0.13
0.13
protein
Probability 0.10
0.10
glutathionation
Probability 0.05
0.05
dna
Probability 0.03
0.03
Showing 5 of 8 metabolites
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