Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 08:59:46 UTC
Update Date2025-03-24 20:07:40 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01346834
Frequency1.0
Structure
Chemical FormulaC6H8O3
Molecular Mass128.0473
SMILESCC1=CC(=O)C(CO)O1
InChI KeyXLEHXWKLUSNIKE-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
  • primary alcohols
  • vinylogous esters
  • Substituents
  • alcohol
  • carbonyl group
  • vinylogous ester
  • cyclic ketone
  • ketone
  • oxacycle
  • organic oxide
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • hydrocarbon derivative
  • primary alcohol
  • 3-furanone
  • organooxygen compound