Substrate
/
Generation 1
XenoSite
Barasertibum
CCN(CCCOc1ccc2c(Nc3cc(CC(=O)Nc4cccc(F)c4)[nH]n3)ncnc2c1)CCOP(=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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CCN(CCCOc1ccc2c(Nc3cc(CC=O)[nH]n3)ncnc2c1)CCOP(=O)(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.
dephosphorylation
Probability 0.38
0.38
dephosphorylation
Probability 0.38
0.38
Phosphonic acid
dealkylation
Probability 0.31
0.31
(11c)acetic acid
dealkylation
Probability 0.31
0.31
An oxidized polyvinyl alcohol
dealkylation
Probability 0.31
0.31
A polyvinyl alcohol
Showing 5 of 147 metabolites
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