Substrate
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Generation 1
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Generation 2
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Generation 3
XenoSite
Acetylsulfamethoxazole
CC(=O)Nc1ccc(S(=O)(=O)Nc2cc(C)on2)cc1
CHEBI
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Description
▾
Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
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Generation 1
Show metabolites
CC(=O)N=C1C=CC(S(=O)(=O)Nc2cc(C)on2)=CC1=O
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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
Show metabolites
CC(=O)N=C1C=CC(S(=O)(=O)Nc2cc(C)on2)=CC1O
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 3
Show metabolites
CC(=O)N=C1C=CC(S(=O)(=O)NC23C=C(C)ON2O3)=CC1O
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 4
Select a metabolite to form the next generation.
dealkylation
Probability 0.98
0.98
dealkylation
Probability 0.98
0.98
dealkylation
Probability 0.27
0.27
dealkylation
Probability 0.13
0.13
(11c)acetic acid
dealkylation
Probability 0.13
0.13