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
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CN1CCC2=C3C(=CC4OC24)c2ccccc2CC31
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 2
Show metabolites
CN1CCC2=C3C(=CC4OC24)C2=CC(=O)C(=O)C=C2CC31
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 3
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CNC1CC2=CC(=O)C(=O)C=C2C2=CC3OC3C(CCO)=C21
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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.
dna
Probability 0.30
0.30
glutathionation
Probability 0.28
0.28
glutathionation
Probability 0.26
0.26
dna
Probability 0.16
0.16
protein
Probability 0.15
0.15
Showing 5 of 8 metabolites
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