Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:51:00 UTC
Update Date2025-03-21 18:02:53 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00040924
Frequency84.2
Structure
Chemical FormulaC5H6O3
Molecular Mass114.0317
SMILESO=CC=CCC(=O)O
InChI KeyTVVCTQKLPXHAPE-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classfatty acyls
Subclass fatty acids and conjugates
Direct Parent straight chain fatty acids
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • aldehydes
  • carboxylic acids
  • fatty acyls
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • straight chain fatty acid
  • carboxylic acid
  • aldehyde
  • carboxylic acid derivative
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • hydrocarbon derivative
  • organooxygen compound