Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:49:09 UTC
Update Date2025-03-21 18:51:16 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00179252
Frequency12.9
Structure
Chemical FormulaC4H8O3
Molecular Mass104.0473
SMILESCCC(=O)OOC
InChI KeyYWTJTYXQYJSKNB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass peroxycarboxylic acids and derivatives
Direct Parent peroxycarboxylic acids and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • peroxycarboxylic acid or derivatives
  • hydrocarbon derivative
  • organooxygen compound