Substrate
/
Generation 1
/
Generation 2
XenoSite
Anthracene
c1ccc2cc3ccccc3cc2c1
CHEBI
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Description
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
stable oxygenation
unstable oxygenation
dehydrogenation
reduction
hydrolysis
Generation 1
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C1=CC2OC2c2cc3ccccc3cc21
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 2
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C1=CC2OC2C23OC2c2ccccc2C=C13
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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.
glutathionation
Probability 0.51
0.51
dna
Probability 0.45
0.45
dna
Probability 0.38
0.38
glutathionation
Probability 0.36
0.36
protein
Probability 0.16
0.16
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