Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:34:16 UTC
Update Date2025-03-21 17:56:33 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00002095
Frequency2918.9
Structure
Chemical FormulaC5H9NO4
Molecular Mass147.0532
SMILESCN(CC(=O)O)CC(=O)O
InChI KeyXWSGEVNYFYKXCP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent alpha amino acids
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • amino acids
  • carbonyl compounds
  • carboxylic acids
  • dicarboxylic acids and derivatives
  • hydrocarbon derivatives
  • organic oxides
  • organopnictogen compounds
  • trialkylamines
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • amino acid
  • tertiary aliphatic amine
  • organic oxide
  • organic oxygen compound
  • alpha-amino acid
  • organonitrogen compound
  • dicarboxylic acid or derivatives
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine
  • tertiary amine
  • organooxygen compound