Substrate
/
Generation 1
XenoSite
Aspartylalanine
CC(NC(=O)C(N)CC(=O)O)C(=O)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
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<small>d</small>-aspartic acid 1-amide
NC(=O)C(N)CC(=O)O
CHEBI
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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
Select a metabolite to form the next generation.
hydrolysis
Probability 0.11
0.11
((sup 13)n)ammonia
hydrolysis
Probability 0.11
0.11
hydrolysis
Probability 0.11
0.11
Aspartic acid-13c4,15n
dealkylation
Probability 0.08
0.08
((sup 13)n)ammonia
dealkylation
Probability 0.08
0.08
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