Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:38:51 UTC
Update Date2025-03-21 17:58:12 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00012845
Frequency352.0
Structure
Chemical FormulaC8H14O2
Molecular Mass142.0994
SMILESCC=CCCCCC(=O)O
InChI KeyOTJVLQGVNKNLCB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classfatty acyls
Subclass fatty acids and conjugates
Direct Parent medium-chain fatty acids
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids
  • fatty acyls
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • straight chain fatty acids
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • straight chain fatty acid
  • carboxylic acid
  • carboxylic acid derivative
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • hydrocarbon derivative
  • medium-chain fatty acid
  • organooxygen compound