Substrate
/
Generation 1
XenoSite
Arachidonoyl-coa
CCCCCC=CCC=CCC=CCC=CCCCC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OCC1OC(n2cnc3c(N)ncnc32)C(O)C1OP(=O)(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
Generation 1
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CCCCCC=CCC=CCC=CCC=CCCCC(=O)SCCNC(=O)CC(=O)O
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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 2
Select a metabolite to form the next generation.
hydrolysis
Probability 0.43
0.43
hydrolysis
Probability 0.43
0.43
Malonic acid
hydrolysis
Probability 0.43
0.43
Malonic semialdehyde
hydrolysis
Probability 0.21
0.21
5,8,11,14-20:4
hydrolysis
Probability 0.21
0.21
Showing 5 of 164 metabolites
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