Substrate
/
Generation 1
/
Generation 2
XenoSite
Annomontine
Nc1nccc(-c2nccc3c2[nH]c2ccccc23)n1
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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N=C(C=CN=C(N)O)c1nccc2c1[nH]c1ccccc12
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 2
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N=C(C=CN=C(N)O)C1=NC2OC2c2c1[nH]c1ccccc21
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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.
epoxidation
Probability 0.35
0.35
hydrogenation
Probability 0.18
0.18
hydrogenation
Probability 0.15
0.15
dealkylation
Probability 0.11
0.11
dealkylation
Probability 0.11
0.11
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