Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:56:15 UTC
Update Date2025-03-25 00:52:17 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02192683
Frequency0.5
Structure
Chemical FormulaC30H56O5
Molecular Mass496.4128
SMILESCCCCCCCCCCCC=CC(=O)OC(CCCCCCCCCCCCC)C(O)C(=O)O
InChI KeyCFELQBHLPJYCCK-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
  • alpha hydroxy acids and derivatives
  • carbonyl compounds
  • carboxylic acids
  • dicarboxylic acids and derivatives
  • enoate esters
  • fatty acid esters
  • hydrocarbon derivatives
  • hydroxy fatty acids
  • long-chain fatty alcohols
  • monosaccharides
  • organic oxides
  • secondary alcohols
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • long-chain fatty acid
  • carboxylic acid
  • alpha-hydroxy acid
  • monosaccharide
  • carboxylic acid derivative
  • alpha,beta-unsaturated carboxylic ester
  • long chain fatty alcohol
  • saccharide
  • organic oxide
  • fatty alcohol
  • hydroxy fatty acid
  • enoate ester
  • alcohol
  • hydroxy acid
  • fatty acid ester
  • organic oxygen compound
  • carboxylic acid ester
  • secondary alcohol
  • dicarboxylic acid or derivatives
  • hydrocarbon derivative
  • organooxygen compound