Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 09:56:28 UTC
Update Date2025-03-24 20:32:21 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01481116
Frequency0.9
Structure
Chemical FormulaC5H8O3
Molecular Mass116.0473
SMILESC=C(OC)C(=O)OC
InChI KeyBTTXESIFAHCXMK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass carboxylic acid derivatives
Direct Parent enoate esters
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • hydrocarbon derivatives
  • methyl esters
  • monocarboxylic acids and derivatives
  • organic oxides
  • Substituents
  • enoate ester
  • aliphatic acyclic compound
  • carbonyl group
  • organic oxide
  • monocarboxylic acid or derivatives
  • methyl ester
  • organic oxygen compound
  • hydrocarbon derivative
  • organooxygen compound