Substrate
/
Generation 1
XenoSite
Anteisoheneicosanoic acid
CCC(C)CCCCCCCCCCCCCCCCC(=O)O
CHEBI
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Description
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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 1
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Isoarachidic acid
CC(C)CCCCCCCCCCCCCCCCC(=O)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.
hydroxylation
Probability 0.10
0.10
hydroxylation
Probability 0.09
0.09
hydroxylation
Probability 0.05
0.05
hydroxylation
Probability 0.05
0.05
hydroxylation
Probability 0.05
0.05
Showing 5 of 116 metabolites
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