Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 02:15:02 UTC
Update Date2025-03-21 20:51:13 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00378329
Frequency4.9
Structure
Chemical FormulaC5H4O3
Molecular Mass112.016
SMILESO=C1C=COC(=O)C1
InChI KeyMERGMNQXULKBCH-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrans
Subclass pyranones and derivatives
Direct Parent dihydropyranones
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • cyclic ketones
  • enol esters
  • hydrocarbon derivatives
  • lactones
  • monocarboxylic acids and derivatives
  • organic oxides
  • oxacyclic compounds
  • Substituents
  • carbonyl group
  • dihydropyranone
  • cyclic ketone
  • carboxylic acid derivative
  • ketone
  • lactone
  • oxacycle
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • aliphatic heteromonocyclic compound
  • hydrocarbon derivative
  • enol ester
  • organooxygen compound