Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 09:36:43 UTC
Update Date2025-03-24 20:23:46 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01435113
Frequency0.9
Structure
Chemical FormulaC6H4O3
Molecular Mass124.016
SMILESC=CC1=CC(=O)OC1=O
InChI KeyFNVVDDWYPIWYQN-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdihydrofurans
Subclass furanones
Direct Parent butenolides
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acid anhydrides
  • dicarboxylic acids and derivatives
  • dihydrofurans
  • hydrocarbon derivatives
  • lactones
  • organic oxides
  • oxacyclic compounds
  • Substituents
  • carbonyl group
  • carboxylic acid derivative
  • lactone
  • oxacycle
  • 2-furanone
  • organic oxide
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • carboxylic acid anhydride
  • dicarboxylic acid or derivatives
  • hydrocarbon derivative
  • organooxygen compound