Substrate
/
Generation 1
XenoSite
Acebutolol
CCCC(=O)Nc1ccc(OCC(O)CNC(C)C)c(C(C)=O)c1
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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Butanal
CCCC=O
CHEBI
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Description
▾
Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
stable oxygenation
unstable oxygenation
dehydrogenation
reduction
hydrolysis
Generation 2
Select a metabolite to form the next generation.
dehydration
Probability 0.58
0.58
Butane
dehydration
Probability 0.58
0.58
15o
hydrogenation
Probability 0.58
0.58
Propyl carbinol
oxygen reduction
Probability 0.58
0.58
Propyl carbinol
hydroxylation
Probability 0.15
0.15
Showing 5 of 21 metabolites
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