Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:56:31 UTC
Update Date2025-03-25 00:52:22 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02193280
Frequency0.5
Structure
Chemical FormulaC23H34O4
Molecular Mass374.2457
SMILESCCCCCC=CCC=CCC=CC=CC=CC(=O)C(O)CCCC(=O)O
InChI KeyKRBHZKGQAGUZKB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classfatty acyls
Subclass fatty acids and conjugates
Direct Parent long-chain fatty acids
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • acryloyl compounds
  • acyloins
  • alpha-hydroxy ketones
  • carboxylic acids
  • enones
  • hydrocarbon derivatives
  • hydroxy fatty acids
  • long-chain fatty alcohols
  • monocarboxylic acids and derivatives
  • monosaccharides
  • organic oxides
  • secondary alcohols
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • long-chain fatty acid
  • carboxylic acid
  • monosaccharide
  • alpha,beta-unsaturated ketone
  • alpha-hydroxy ketone
  • carboxylic acid derivative
  • ketone
  • long chain fatty alcohol
  • saccharide
  • organic oxide
  • fatty alcohol
  • hydroxy fatty acid
  • enone
  • alcohol
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • acyloin
  • secondary alcohol
  • hydrocarbon derivative
  • acryloyl-group
  • organooxygen compound