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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:40:46 UTC
Update Date2025-03-25 00:46:49 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02157484
Frequency0.5
Structure
Chemical FormulaC17H30O6
Molecular Mass330.2042
SMILESO=C(O)CCCCCCCCCCC(O)C=CC(O)CC(=O)O
InChI KeyYURIQUCZUMYBDJ-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
  • 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
  • hydroxy acid
  • carboxylic acid derivative
  • long chain fatty alcohol
  • beta-hydroxy acid
  • organic oxide
  • organic oxygen compound
  • fatty alcohol
  • secondary alcohol
  • dicarboxylic acid or derivatives
  • hydrocarbon derivative
  • hydroxy fatty acid
  • organooxygen compound