Substrate
/
Generation 1
XenoSite
Aerobactin
CC(=O)N(O)CCCCC(NC(=O)CC(O)(CC(=O)NC(CCCCN(O)C(C)=O)C(=O)[O-])C(=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
stable oxygenation
unstable oxygenation
dehydrogenation
reduction
hydrolysis
Generation 1
Show metabolites
An oxidized polyvinyl alcohol
CC=O
CHEBI
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Description
▾
Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
gsh
protein
cyanide
dna
Generation 2
Select a metabolite to form the next generation.
glutathionation
Probability 0.60
0.60
dna
Probability 0.44
0.44
protein
Probability 0.42
0.42
cyanide
Probability 0.04
0.04