Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:05:56 UTC
Update Date2025-03-25 00:55:56 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02215051
Frequency0.5
Structure
Chemical FormulaC5H10O4
Molecular Mass134.0579
SMILESCCC(=O)OCOOC
InChI KeyBQRXGGMDHCCPLI-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass carboxylic acid derivatives
Direct Parent carboxylic acid esters
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • dialkyl peroxides
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • dialkyl peroxide
  • hydrocarbon derivative
  • organooxygen compound