Substrate
/
Generation 1
/
Generation 2
XenoSite
Aspernigrin a
NC(=O)c1c[nH]c(Cc2ccccc2)cc1=O
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
NC(=O)c1c[nH]c(CC2=CC=CC(=O)C2=O)cc1=O
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 2
Show metabolites
NC(=O)c1c[nH]c(CC23OC2C=CC(=O)C3=O)cc1=O
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 3
Select a metabolite to form the next generation.
dealkylation
Probability 0.11
0.11
((sup 13)n)ammonia
dealkylation
Probability 0.11
0.11
dealkylation
Probability 0.01
0.01
dealkylation
Probability 0.01
0.01
dealkylation
Probability 0.00
0.00