Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:25:29 UTC
Update Date2025-03-21 18:38:59 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00123469
Frequency20.9
Structure
Chemical FormulaC4H6O4
Molecular Mass118.0266
SMILESCC(=O)OOC(C)=O
InChI KeyZQMIGQNCOMNODD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass dicarboxylic acids and derivatives
Direct Parent diacyl peroxides
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • acetate salts
  • carbonyl compounds
  • hydrocarbon derivatives
  • organic oxides
  • organic salts
  • peroxycarboxylic acids and derivatives
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • acetate salt
  • organic oxide
  • organic oxygen compound
  • diacyl peroxide
  • peroxycarboxylic acid or derivatives
  • hydrocarbon derivative
  • organic salt
  • organooxygen compound