Substrate
/
Generation 1
XenoSite
Aspergillide b
CC1CCCC=CC2CCC(O)C(CC(=O)O1)O2
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=CC1CCC(O)C(CC(=O)OC(C)CC=O)O1
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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 0.70
0.70
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protein
Probability 0.49
0.49
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dna
Probability 0.33
0.33
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cyanide
Probability 0.09
0.09
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