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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:12:21 UTC
Update Date2025-03-25 00:58:15 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02229536
Frequency0.5
Structure
Chemical FormulaC36H72O3
Molecular Mass552.5481
SMILESCCCCCCCCCCCC(=O)OC(CCCCCCCCCCC)C(O)CCCCCCCCCCC
InChI KeyJLDAFTBUQHMFQW-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classfatty acyls
Subclass fatty alcohols
Direct Parent long-chain fatty alcohols
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acid esters
  • fatty acid esters
  • fatty alcohol esters
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • secondary alcohols
    • Substituents
  • alcohol
  • aliphatic acyclic compound
  • carbonyl group
  • fatty alcohol ester
  • carboxylic acid derivative
  • long chain fatty alcohol
  • fatty acid ester
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • secondary alcohol
  • hydrocarbon derivative
  • organooxygen compound