Substrate
/
Generation 1
/
Generation 2
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
Generation 1
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CCOC(=O)C(CCNCCc1ccc(N)cc1)(CC(=O)O)c1ccccc1
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 2
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CCOC(=O)C(CCNCCc1ccc(N)cc1)(CC(=O)O)C1=CC=CC2OC12
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
stable oxygenation
unstable oxygenation
dehydrogenation
reduction
hydrolysis
Generation 3
Select a metabolite to form the next generation.
hydrolysis
Probability 0.53
0.53
A polyvinyl alcohol
hydrolysis
Probability 0.53
0.53
hydrolysis
Probability 0.53
0.53
dealkylation
Probability 0.24
0.24
dealkylation
Probability 0.24
0.24
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