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
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N=C1C(I)=CC(=O)C(C(=O)[O-])=C1I
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 2
Show metabolites
N=C1C(I)=C(C(=O)[O-])C(=O)C2OC12I
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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.
dna
Probability 0.61
0.61
dna
Probability 0.48
0.48
dna
Probability 0.48
0.48
protein
Probability 0.46
0.46
glutathionation
Probability 0.42
0.42
Showing 5 of 16 metabolites
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