Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 04:42:39 UTC
Update Date2025-03-24 14:01:23 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00728900
Frequency2.1
Structure
Chemical FormulaC6H12O3
Molecular Mass132.0786
SMILESCCOC(C)C(=O)OC
InChI KeyYVWPDYFVVMNWDT-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass carboxylic acid derivatives
Direct Parent methyl esters
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • dialkyl ethers
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • ether
  • dialkyl ether
  • organic oxide
  • monocarboxylic acid or derivatives
  • methyl ester
  • organic oxygen compound
  • hydrocarbon derivative
  • organooxygen compound