Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:11:44 UTC
Update Date2025-03-21 18:32:18 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00090138
Frequency31.3
Structure
Chemical FormulaC17H30O4
Molecular Mass298.2144
SMILESCCCCCCCCCCCC=CC(=O)OC(C)C(=O)O
InChI KeySTFJKCFXWXYNJD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classfatty acyls
Subclass fatty acid esters
Direct Parent fatty acid esters
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids
  • dicarboxylic acids and derivatives
  • enoate esters
  • hydrocarbon derivatives
  • organic oxides
  • Substituents
  • enoate ester
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • carboxylic acid derivative
  • alpha,beta-unsaturated carboxylic ester
  • fatty acid ester
  • organic oxide
  • organic oxygen compound
  • carboxylic acid ester
  • dicarboxylic acid or derivatives
  • hydrocarbon derivative
  • organooxygen compound