Substrate
/
Generation 1
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Generation 2
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Generation 3
XenoSite
Aporphine
CN1CCc2cccc3c2C1Cc1ccccc1-3
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
CN1CCc2cccc3c2C1CC1=CC2OC2C=C13
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 2
Show metabolites
CN1CCC2=CC(=O)C=C3C4=CC5OC5C=C4CC1=C23
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 3
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CNC1=C2C(CC(=O)O)=CC(=O)C=C2C2=CC3OC3C=C2C1
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
gsh
protein
cyanide
dna
Generation 4
Select a metabolite to form the next generation.
glutathionation
Probability 0.28
0.28
dna
Probability 0.27
0.27
dna
Probability 0.25
0.25
glutathionation
Probability 0.25
0.25
protein
Probability 0.13
0.13
Showing 5 of 8 metabolites
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