Substrate
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Generation 1
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Generation 2
XenoSite
Arginylmethionine
CSCCC(NC(=O)C(N)CCCNC(=N)N)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
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C[S+]([O-])CCC(NC(=O)C(N)CCCNC(=N)N)C(=O)O
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 2
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C[S+]([O-])CCC(NC(=O)C(N)CCCNC1(N)NO1)C(=O)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 0.96
0.96
dealkylation
Probability 0.96
0.96
((sup 13)n)ammonia
dealkylation
Probability 0.94
0.94
dealkylation
Probability 0.93
0.93
dealkylation
Probability 0.93
0.93
Showing 5 of 17 metabolites
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