Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 02:46:30 UTC
Update Date2025-03-21 21:57:45 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00453384
Frequency3.9
Structure
Chemical FormulaC3H2O4
Molecular Mass101.9953
SMILESO=C1OCOC1=O
InChI KeyIVJSVTUVNPAOTO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass dicarboxylic acids and derivatives
Direct Parent dicarboxylic acids and derivatives
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • 1,3-dioxolanes
  • acetals
  • carbonyl compounds
  • carboxylic acid esters
  • hydrocarbon derivatives
  • lactones
  • organic oxides
  • oxacyclic compounds
  • Substituents
  • meta-dioxolane
  • carbonyl group
  • lactone
  • oxacycle
  • organic oxide
  • organic oxygen compound
  • acetal
  • carboxylic acid ester
  • aliphatic heteromonocyclic compound
  • dicarboxylic acid or derivatives
  • hydrocarbon derivative
  • organoheterocyclic compound
  • organooxygen compound