Substrate
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Generation 1
XenoSite
Aculene a
CCC1=CC(=O)C2(C)C1=CC=C(C)CC2OC(=O)C1CCC[NH2+]1
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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Show metabolites
C=C1CC(OC(=O)C2CCC[NH2+]2)C2(C)C(=O)C=C(CC)C2=CC1=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 0.59
0.59
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protein
Probability 0.46
0.46
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dna
Probability 0.23
0.23
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cyanide
Probability 0.01
0.01
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