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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:56:02 UTC
Update Date2025-03-25 00:52:11 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02192174
Frequency0.5
Structure
Chemical FormulaC13H26O2
Molecular Mass214.1933
SMILESCCCCCCCCC(C)CC(=O)OC
InChI KeyMASJCLNVVYPLQG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classfatty acyls
Subclass fatty acid esters
Direct Parent fatty acid methyl esters
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • hydrocarbon derivatives
  • methyl esters
  • monocarboxylic acids and derivatives
  • organic oxides
    • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid derivative
  • organic oxide
  • monocarboxylic acid or derivatives
  • fatty acid methyl ester
  • methyl ester
  • organic oxygen compound
  • carboxylic acid ester
  • hydrocarbon derivative
  • organooxygen compound