Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 05:52:17 UTC
Update Date2025-03-24 14:37:15 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00895876
Frequency1.6
Structure
Chemical FormulaC7H10O3
Molecular Mass142.063
SMILESCCC=C(C=O)OC(C)=O
InChI KeyFZEAJOUSBMDFDG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass carboxylic acid derivatives
Direct Parent enol esters
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • aldehydes
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • aldehyde
  • hydrocarbon derivative
  • enol ester
  • organooxygen compound