Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:58:33 UTC
Update Date2025-03-25 00:53:05 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02197870
Frequency0.5
Structure
Chemical FormulaC8H4O4
Molecular Mass164.011
SMILESO=C1C=C(O)C(=O)c2occc21
InChI KeyTWUGYQWMBKYSPM-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classfurans
Subclass furoic acid and derivatives
Direct Parent furoic acid and derivatives
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • aryl ketones
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organic oxides
  • organooxygen compounds
  • oxacyclic compounds
  • vinylogous acids
  • Substituents
  • furoic acid or derivatives
  • heteroaromatic compound
  • ketone
  • oxacycle
  • vinylogous acid
  • organic oxide
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • hydrocarbon derivative
  • organooxygen compound
  • aryl ketone