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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:06:23 UTC
Update Date2025-03-25 00:56:05 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02216060
Frequency0.5
Structure
Chemical FormulaC23H40O5
Molecular Mass396.2876
SMILESCCCCC=CC(=O)OC(C(=O)O)C(O)C=CCCCCCCCCCCC
InChI KeyMUDIVMXEUQKUMQ-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
  • beta 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
  • organic oxides
  • secondary alcohols
  • Substituents
  • enoate ester
  • alcohol
  • aliphatic acyclic compound
  • carbonyl group
  • long-chain fatty acid
  • carboxylic acid
  • hydroxy acid
  • carboxylic acid derivative
  • alpha,beta-unsaturated carboxylic ester
  • long chain fatty alcohol
  • fatty acid ester
  • beta-hydroxy acid
  • organic oxide
  • organic oxygen compound
  • fatty alcohol
  • carboxylic acid ester
  • secondary alcohol
  • dicarboxylic acid or derivatives
  • hydrocarbon derivative
  • hydroxy fatty acid
  • organooxygen compound