Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 05:38:24 UTC
Update Date2025-03-24 14:30:57 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00862894
Frequency1.7
Structure
Chemical FormulaC5H10O3
Molecular Mass118.063
SMILESCOC(C=O)C(C)O
InChI KeyXPWYHPQVIWRPIJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent beta-hydroxy aldehydes
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • dialkyl ethers
  • hydrocarbon derivatives
  • organic oxides
  • secondary alcohols
  • short-chain aldehydes
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • beta-hydroxy aldehyde
  • short-chain aldehyde
  • ether
  • dialkyl ether
  • organic oxide
  • secondary alcohol
  • hydrocarbon derivative