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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:57:03 UTC
Update Date2025-03-25 00:52:32 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02194461
Frequency0.5
Structure
Chemical FormulaC11H20O5
Molecular Mass232.1311
SMILESCCCCCCCCOC(=O)C(O)C(=O)O
InChI KeyRGJYLMJWMRSZMV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classfatty acyls
Subclass fatty alcohol esters
Direct Parent fatty alcohol esters
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • 1,3-dicarbonyl compounds
  • alpha hydroxy acids and derivatives
  • carboxylic acid esters
  • carboxylic acids
  • dicarboxylic acids and derivatives
  • hydrocarbon derivatives
  • monosaccharides
  • organic oxides
  • secondary alcohols
    • Substituents
  • alcohol
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • fatty alcohol ester
  • alpha-hydroxy acid
  • monosaccharide
  • hydroxy acid
  • carboxylic acid derivative
  • saccharide
  • organic oxide
  • organic oxygen compound
  • carboxylic acid ester
  • secondary alcohol
  • dicarboxylic acid or derivatives
  • hydrocarbon derivative
  • 1,3-dicarbonyl compound
  • organooxygen compound