Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 07:51:44 UTC
Update Date2025-03-24 22:23:48 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01182124
Frequency1.1
Structure
Chemical FormulaC7H12O3
Molecular Mass144.0786
SMILESO=CCCCCC(=O)CO
InChI KeyLCMGQJFTVDGLPZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classfatty acyls
Subclass fatty alcohols
Direct Parent fatty alcohols
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alcohols and polyols
  • alpha-hydrogen aldehydes
  • alpha-hydroxy ketones
  • hydrocarbon derivatives
  • medium-chain aldehydes
  • monosaccharides
  • organic oxides
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • carbonyl group
  • monosaccharide
  • aldehyde
  • alpha-hydroxy ketone
  • medium-chain aldehyde
  • ketone
  • saccharide
  • organic oxide
  • organic oxygen compound
  • fatty alcohol
  • alpha-hydrogen aldehyde
  • hydrocarbon derivative
  • organooxygen compound