Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:01:13 UTC
Update Date2025-03-21 18:06:46 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00065048
Frequency47.2
Structure
Chemical FormulaC14H26O3
Molecular Mass242.1882
SMILESCCCCCCCCCCCC(=O)OC(C)=O
InChI KeyBRXPETQWSNQLQV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass dicarboxylic acids and derivatives
Direct Parent dicarboxylic acids and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acid anhydrides
  • hydrocarbon derivatives
  • organic oxides
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • organic oxide
  • organic oxygen compound
  • carboxylic acid anhydride
  • dicarboxylic acid or derivatives
  • hydrocarbon derivative
  • organooxygen compound