Substrate
/
Generation 1
XenoSite
Anthracene
c1ccc2cc3ccccc3cc2c1
CHEBI
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Description
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
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Generation 1
Show metabolites
O=C1C=CC=c2cc3c(cc21)=CC=CC3=O
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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 2
Select a metabolite to form the next generation.
dehydration
Probability 0.68
0.68
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15o
dehydration
Probability 0.68
0.68
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hydrogenation
Probability 0.68
0.68
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oxygen reduction
Probability 0.68
0.68
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hydrogenation
Probability 0.16
0.16
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Showing 5 of 43 metabolites
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