Substrate
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Generation 1
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Generation 2
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
About this model
Generation 1
Show metabolites
O=C([O-])c1c(I)cc(I)c(O)c1I
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 2
Show metabolites
O=C([O-])C1=C(I)C2(O)OC2(I)C=C1I
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
gsh
protein
cyanide
dna
Generation 3
Select a metabolite to form the next generation.
glutathionation
Probability 0.38
0.38
glutathionation
Probability 0.38
0.38
glutathionation
Probability 0.37
0.37
protein
Probability 0.28
0.28
protein
Probability 0.20
0.20
Showing 5 of 20 metabolites
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