Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:52:14 UTC
Update Date2025-03-25 01:13:12 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02321059
Frequency0.5
Structure
Chemical FormulaC5H8O4
Molecular Mass132.0423
SMILESCCOC(=CO)C(=O)O
InChI KeyLNELLKIAWKUOOR-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classvinylogous acids
Subclass vinylogous acids
Direct Parent vinylogous acids
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • Substituents
  • aliphatic acyclic compound
  • vinylogous acid
  • carbonyl group
  • organic oxide
  • monocarboxylic acid or derivatives
  • carboxylic acid
  • organic oxygen compound
  • hydrocarbon derivative
  • carboxylic acid derivative
  • organooxygen compound