Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:43:22 UTC
Update Date2025-03-21 17:59:43 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00022828
Frequency173.2
Structure
Chemical FormulaC6H8O4
Molecular Mass144.0423
SMILESCC(=O)CC(=O)OC(C)=O
InChI KeyRYLHMXPGTMYTTF-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classketo acids and derivatives
Subclass beta-keto acids and derivatives
Direct Parent beta-keto acids and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carboxylic acid anhydrides
  • dicarboxylic acids and derivatives
  • hydrocarbon derivatives
  • ketones
  • organic oxides
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid derivative
  • beta-keto acid
  • ketone
  • organic oxide
  • organic oxygen compound
  • carboxylic acid anhydride
  • dicarboxylic acid or derivatives
  • hydrocarbon derivative
  • organooxygen compound