Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:59:03 UTC
Update Date2025-03-21 18:05:56 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00059903
Frequency52.4
Structure
Chemical FormulaC22H36O3
Molecular Mass348.2664
SMILESCCCCCC=CCC=CCC=CCC=CCCCC(=O)OCCO
InChI KeyZWXLHTWQEHZSAD-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
  • alcohols and polyols
  • carbonyl compounds
  • carboxylic acid esters
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid derivative
  • fatty acid ester
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • hydrocarbon derivative
  • organooxygen compound