Substrate
/
Generation 1
/
Generation 2
XenoSite
Alpha-methylnaphthalene
Cc1cccc2ccccc12
CHEBI
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Description
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 1
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Cc1cccc2c1=CC1OC1C=2
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 2
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C=C1C(=O)C=CC2=CC3OC3C=C12
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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 3
Select a metabolite to form the next generation.
dehydration
Probability 0.41
0.41
dehydration
Probability 0.41
0.41
15o
hydrogenation
Probability 0.41
0.41
oxygen reduction
Probability 0.41
0.41
hydrogenation
Probability 0.21
0.21
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