Substrate
/
Generation 1
/
Generation 2
XenoSite
Anthranil
c1ccc2nocc2c1
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
Show metabolites
O=C1C=CC=C2C(=O)ON=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 2
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O=C1ON=C2C1=CC=CC2O
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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 0.30
0.30
15o
dehydration
Probability 0.30
0.30
hydrogenation
Probability 0.30
0.30
oxygen reduction
Probability 0.30
0.30
hydrogenation
Probability 0.26
0.26
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