Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:03:48 UTC
Update Date2025-03-25 00:55:01 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02210045
Frequency0.5
Structure
Chemical FormulaC6H13NO3+
Molecular Mass147.089
SMILESCC(O)C(O)C(=O)[N+](C)C
InChI KeyAKTAXORTYZVZEF-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classfatty acyls
Subclass fatty amides
Direct Parent n-acyl amines
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • 1,2-diols
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • monosaccharides
  • organic cations
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary alcohols
  • tertiary carboxylic acid amides
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • carbonyl group
  • monosaccharide
  • carboxamide group
  • carboxylic acid derivative
  • n-acyl-amine
  • saccharide
  • organic oxide
  • organic oxygen compound
  • tertiary carboxylic acid amide
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organic cation
  • organooxygen compound
  • 1,2-diol