Substrate
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Generation 1
XenoSite
Adipiodone dianion
O=C(CCCCC(=O)Nc1c(I)cc(I)c(C(=O)[O-])c1I)Nc1c(I)cc(I)c(C(=O)[O-])c1I
CHEBI
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Description
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
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Generation 1
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Nc1c(I)cc(I)c(C(=O)[O-])c1I
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
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stable oxygenation
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unstable oxygenation
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dehydrogenation
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reduction
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hydrolysis
Generation 2
Select a metabolite to form the next generation.
dealkylation
Probability 0.09
0.09
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((sup 13)n)ammonia
dealkylation
Probability 0.08
0.08
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hydrogenation
Probability 0.05
0.05
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dealkylation
Probability 0.02
0.02
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dealkylation
Probability 0.02
0.02
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15o
Showing 5 of 10 metabolites
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