Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 05:49:35 UTC
Update Date2025-03-24 14:35:57 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00889464
Frequency1.6
Structure
Chemical FormulaC5H8O3
Molecular Mass116.0473
SMILESCCOC(O)=CC=O
InChI KeyMWXNSLPIOGPMDB-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
  • hydrocarbon derivatives
  • organic oxides
  • short-chain aldehydes
  • vinylogous esters
  • Substituents
  • aliphatic acyclic compound
  • vinylogous acid
  • carbonyl group
  • organic oxide
  • short-chain aldehyde
  • organic oxygen compound
  • vinylogous ester
  • aldehyde
  • hydrocarbon derivative
  • organooxygen compound