Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 05:53:19 UTC
Update Date2025-03-24 14:37:44 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00898281
Frequency1.6
Structure
Chemical FormulaC7H6O3
Molecular Mass138.0317
SMILESCC(=O)c1coc(C=O)c1
InChI KeyVTFFOJKOBUEXAO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classfurans
Subclass furoic acid and derivatives
Direct Parent furoic acid and derivatives
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • aryl alkyl ketones
  • aryl-aldehydes
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organic oxides
  • organooxygen compounds
  • oxacyclic compounds
  • Substituents
  • furoic acid or derivatives
  • aryl alkyl ketone
  • aromatic heteromonocyclic compound
  • heteroaromatic compound
  • aldehyde
  • ketone
  • oxacycle
  • organic oxide
  • aryl-aldehyde
  • organic oxygen compound
  • hydrocarbon derivative
  • organooxygen compound
  • aryl ketone