Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 08:18:38 UTC
Update Date2025-03-25 00:14:31 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01248884
Frequency1.1
Structure
Chemical FormulaC7H10O3
Molecular Mass142.063
SMILESCC1=CC(=O)C(C(C)O)O1
InChI KeyAEPALCUIRBAUQX-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdihydrofurans
Subclass furanones
Direct Parent furanones
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • cyclic ketones
  • hydrocarbon derivatives
  • organic oxides
  • oxacyclic compounds
  • secondary alcohols
  • vinylogous esters
  • Substituents
  • alcohol
  • carbonyl group
  • vinylogous ester
  • cyclic ketone
  • ketone
  • oxacycle
  • organic oxide
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • secondary alcohol
  • hydrocarbon derivative
  • 3-furanone
  • organooxygen compound