Substrate
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Generation 1
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Generation 2
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Generation 3
XenoSite
Anileridine
CCOC(=O)C1(c2ccccc2)CCN(CCc2ccc(N)cc2)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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Generation 1
Show metabolites
CCOC(=O)C1(C2=CC(=O)C(=O)C=C2)CCN(CCc2ccc(N)cc2)CC1
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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
CCOC(=O)C1(C2=CC(=O)C(=O)C=C2)CCN(CCC23C=CC(N)=CC2O3)CC1
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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
CCOC(=O)C(CCNCCC12C=CC(N)=CC1O2)(CC(=O)O)C1=CC(=O)C(=O)C=C1
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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 4
Select a metabolite to form the next generation.
hydrolysis
Probability 0.57
0.57
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A polyvinyl alcohol
hydrolysis
Probability 0.57
0.57
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hydrolysis
Probability 0.57
0.57
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hydrogenation
Probability 0.22
0.22
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hydrogenation
Probability 0.21
0.21
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Showing 5 of 132 metabolites
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