Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 05:33:24 UTC
Update Date2025-03-24 14:28:46 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00851172
Frequency1.7
Structure
Chemical FormulaC6H10O3
Molecular Mass130.063
SMILESCC(=O)C(O)CCC=O
InChI KeyDTNHNFGZENZOHE-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
  • acyloins
  • alpha-hydrogen aldehydes
  • alpha-hydroxy ketones
  • hydrocarbon derivatives
  • monosaccharides
  • organic oxides
  • secondary alcohols
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • monosaccharide
  • alpha-hydroxy ketone
  • medium-chain aldehyde
  • ketone
  • saccharide
  • organic oxide
  • alpha-hydrogen aldehyde
  • acyloin
  • secondary alcohol
  • hydrocarbon derivative