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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:43:50 UTC
Update Date2025-03-25 00:47:50 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02164338
Frequency0.5
Structure
Chemical FormulaC15H28N2O11
Molecular Mass412.1693
SMILESCC(O)C(N)C(=O)NC1OC(CO)C(OC2OC(CO)C(O)C(O)C2O)C1O
InChI KeyQIFIWJKBBKDRKZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent alpha amino acid amides
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • acetals
  • alpha amino acids
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • monoalkylamines
  • monosaccharides
  • n-acyl amines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • oxanes
  • primary alcohols
  • secondary alcohols
  • secondary carboxylic acid amides
  • tetrahydrofurans
    • Substituents
  • fatty acyl
  • carbonyl group
  • fatty amide
  • monosaccharide
  • saccharide
  • organic oxide
  • acetal
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • oxane
  • primary alcohol
  • organoheterocyclic compound
  • alcohol
  • alpha-amino acid amide
  • tetrahydrofuran
  • carboxamide group
  • n-acyl-amine
  • oxacycle
  • secondary carboxylic acid amide
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound