Substrate
/
Generation 1
XenoSite
Antofine
COc1ccc2c3c(c4cc(OC)c(OC)cc4c2c1)CC1CCCN1C3
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
Formaldehyde
C=O
CHEBI
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Description
▾
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 0.99
0.99
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protein
Probability 0.91
0.91
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dna
Probability 0.51
0.51
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cyanide
Probability 0.13
0.13
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