Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 11:15:07 UTC
Update Date2025-03-24 21:05:48 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01670323
Frequency0.7
Structure
Chemical FormulaC4H4O4
Molecular Mass116.011
SMILESO=CC1OC(=O)C1O
InChI KeyPEAHZUBIOPCIKF-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent alpha-acyloxy aldehydes
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • aldehydes
  • beta propiolactones
  • carboxylic acid esters
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • oxacyclic compounds
  • oxetanes
  • secondary alcohols
  • Substituents
  • alcohol
  • aldehyde
  • carboxylic acid derivative
  • beta_propiolactone
  • lactone
  • oxacycle
  • organic oxide
  • monocarboxylic acid or derivatives
  • carboxylic acid ester
  • oxetane
  • aliphatic heteromonocyclic compound
  • secondary alcohol
  • hydrocarbon derivative
  • alpha-acyloxy aldehyde
  • organoheterocyclic compound