Substrate
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Generation 1
XenoSite
Acetonylacetone
CC(=O)CCC(C)=O
CHEBI
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Description
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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 1
Show metabolites
CC(=O)C=CC(C)=O
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
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gsh
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protein
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cyanide
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dna
Generation 2
Select a metabolite to form the next generation.
glutathionation
Probability 0.46
0.46
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dna
Probability 0.31
0.31
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protein
Probability 0.24
0.24
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cyanide
Probability 0.00
0.00
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