Substrate
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Generation 1
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Generation 2
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Generation 3
XenoSite
Arachidonoylserotonin
CCCCCC=CCC=CCC=CCC=CCCCC(=O)NCCc1c[nH]c2ccc(O)cc12
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)NCC=C1C(=O)Nc2ccc(O)cc21
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 2
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CCCCCC=CCC=CCC=CCC1OC1CCCC(=O)NCC=C1C(=O)Nc2ccc(O)cc21
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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
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CCCCCC=CCC=CCCCCC1OC1CCCC(=O)NCC=C1C(=O)Nc2ccc(O)cc21
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 4
Select a metabolite to form the next generation.
epoxidation
Probability 0.14
0.14
epoxidation
Probability 0.11
0.11
epoxidation
Probability 0.09
0.09
epoxidation
Probability 0.02
0.02
epoxidation
Probability 0.01
0.01
Showing 5 of 9 metabolites
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