Substrate
/
Generation 1
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Generation 2
XenoSite
Aminohippurate
Nc1ccc(C(=O)NCC(=O)[O-])cc1
CHEBI
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Description
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
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stable oxygenation
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unstable oxygenation
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dehydrogenation
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reduction
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hydrolysis
Generation 1
Show metabolites
P-aminobenzaldehyde
Nc1ccc(C=O)cc1
CHEBI
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
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Generation 2
Show metabolites
NC12C=CC(C=O)=CC1O2
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
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gsh
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protein
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cyanide
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dna
Generation 3
Select a metabolite to form the next generation.
glutathionation
Probability 0.45
0.45
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protein
Probability 0.14
0.14
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dna
Probability 0.04
0.04
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cyanide
Probability 0.01
0.01
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