Substrate
/
Generation 1
XenoSite
Agmatine
NC(=[NH2+])NCCCC[NH3+]
CHEBI
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Description
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
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Generation 1
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4-aminobutanal
[NH3+]CCCC=O
CHEBI
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Description
▾
Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
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stable oxygenation
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unstable oxygenation
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dehydrogenation
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reduction
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hydrolysis
Generation 2
Select a metabolite to form the next generation.
dehydration
Probability 0.49
0.49
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Butylamine
dehydration
Probability 0.49
0.49
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15o
hydrogenation
Probability 0.49
0.49
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oxygen reduction
Probability 0.49
0.49
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dealkylation
Probability 0.09
0.09
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Formaldehyde
Showing 5 of 36 metabolites
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