Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:26:36 UTC
Update Date2025-03-25 00:41:41 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02124821
Frequency0.6
Structure
Chemical FormulaC7H6O3
Molecular Mass138.0317
SMILESC=CC1=C(O)C(=O)C(=C)O1
InChI KeyMBQSALWVMWIHON-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
  • vinylogous esters
  • Substituents
  • carbonyl group
  • vinylogous ester
  • cyclic ketone
  • ketone
  • oxacycle
  • organic oxide
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • hydrocarbon derivative
  • 3-furanone
  • organooxygen compound