Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:44:45 UTC
Update Date2025-03-21 18:49:45 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00168757
Frequency13.9
Structure
Chemical FormulaC6H10O3
Molecular Mass130.063
SMILESCC(=O)CCC(O)C=O
InChI KeyJVIKTOSGQRBHPB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent medium-chain aldehydes
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alpha-hydroxyaldehydes
  • hydrocarbon derivatives
  • ketones
  • monosaccharides
  • organic oxides
  • secondary alcohols
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • monosaccharide
  • medium-chain aldehyde
  • ketone
  • saccharide
  • organic oxide
  • alpha-hydroxyaldehyde
  • secondary alcohol
  • hydrocarbon derivative