Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:20:02 UTC
Update Date2025-03-21 18:36:23 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00110428
Frequency24.1
Structure
Chemical FormulaC7H11NO5
Molecular Mass189.0637
SMILESNC(CCC(=O)O)C(=O)CC(=O)O
InChI KeyHSAWRIMBVAHRHU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent gamma amino acids and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • amino fatty acids
  • beta-hydroxy ketones
  • beta-keto acids and derivatives
  • carboxylic acids
  • dicarboxylic acids and derivatives
  • fatty acyls
  • hydrocarbon derivatives
  • medium-chain keto acids and derivatives
  • monoalkylamines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • fatty acyl
  • beta-hydroxy ketone
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • gamma amino acid or derivatives
  • amino fatty acid
  • beta-keto acid
  • ketone
  • organic oxide
  • organic oxygen compound
  • keto acid
  • organonitrogen compound
  • dicarboxylic acid or derivatives
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound
  • medium-chain keto acid