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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:04:59 UTC
Update Date2025-03-25 00:55:33 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02212933
Frequency0.5
Structure
Chemical FormulaC38H70O5
Molecular Mass606.5223
SMILESCCCCCCCC=CCCCCCCCC(O)C(CC(=O)O)OC(=O)CCCCCCCC=CCCCCCCCC
InChI KeyFZLXQUFSUZCALG-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
  • carbonyl compounds
  • carboxylic acid esters
  • carboxylic acids
  • dicarboxylic acids and derivatives
  • fatty acid esters
  • hydrocarbon derivatives
  • hydroxy fatty acids
  • long-chain fatty alcohols
  • organic oxides
  • secondary alcohols
    • Substituents
  • alcohol
  • aliphatic acyclic compound
  • carbonyl group
  • long-chain fatty acid
  • carboxylic acid
  • carboxylic acid derivative
  • long chain fatty alcohol
  • fatty acid ester
  • organic oxide
  • organic oxygen compound
  • fatty alcohol
  • carboxylic acid ester
  • secondary alcohol
  • dicarboxylic acid or derivatives
  • hydrocarbon derivative
  • hydroxy fatty acid
  • organooxygen compound