Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 04:32:50 UTC
Update Date2025-03-24 13:57:53 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00705102
Frequency2.2
Structure
Chemical FormulaC5H8O4
Molecular Mass132.0423
SMILESCOC(=O)C(=O)CCO
InChI KeyGRNVOIGSTOCENT-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classfatty acyls
Subclass fatty acid esters
Direct Parent fatty acid esters
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alcohols and polyols
  • alpha-keto acids and derivatives
  • beta-hydroxy ketones
  • hydrocarbon derivatives
  • methyl esters
  • monocarboxylic acids and derivatives
  • organic oxides
  • Substituents
  • alcohol
  • beta-hydroxy ketone
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid derivative
  • ketone
  • fatty acid ester
  • organic oxide
  • monocarboxylic acid or derivatives
  • methyl ester
  • organic oxygen compound
  • keto acid
  • carboxylic acid ester
  • alpha-keto acid
  • hydrocarbon derivative
  • organooxygen compound