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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:48:03 UTC
Update Date2025-03-25 00:49:24 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02173996
Frequency0.5
Structure
Chemical FormulaC13H22N2O5
Molecular Mass286.1529
SMILESCCCCCC=CC(O)C(=O)C(N)C(=O)NCC(=O)O
InChI KeyRYEUTKGUJGJNHM-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent acyl glycines
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • 1,3-dicarbonyl compounds
  • acyloins
  • alpha amino acid amides
  • alpha amino acids
  • alpha-hydroxy ketones
  • carboxylic acids
  • dipeptides
  • hydrocarbon derivatives
  • monoalkylamines
  • monocarboxylic acids and derivatives
  • monosaccharides
  • n-acyl amines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary alcohols
  • secondary carboxylic acid amides
    • Substituents
  • fatty acyl
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • fatty amide
  • monosaccharide
  • alpha-hydroxy ketone
  • alpha peptide
  • ketone
  • saccharide
  • organic oxide
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • alcohol
  • alpha-amino acid amide
  • carboxamide group
  • n-acyl-amine
  • n-acylglycine
  • alpha-dipeptide
  • secondary carboxylic acid amide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • acyloin
  • secondary alcohol
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • 1,3-dicarbonyl compound
  • organooxygen compound