Substrate
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Generation 1
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Generation 2
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Generation 3
XenoSite
Acetylcaranine
CC(=O)OC1CC=C2CCN3Cc4cc5c(cc4C1C23)OCO5
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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Generation 1
Show metabolites
CC(=O)OC1CC=C2CCNC2C1c1cc2c(cc1CO)OCO2
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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
CC(=O)OC1CC=C2CCNC2C1C1=CC(=O)C(=O)C=C1CO
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
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Generation 3
Show metabolites
CC(=O)OC1CC=C2CCNC2C1C12OC1C(=O)C(=O)C=C2CO
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
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gsh
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protein
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cyanide
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dna
Generation 4
Select a metabolite to form the next generation.
glutathionation
Probability 0.16
0.16
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dna
Probability 0.03
0.03
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protein
Probability 0.03
0.03
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dna
Probability 0.02
0.02
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glutathionation
Probability 0.01
0.01
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Showing 5 of 8 metabolites
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