Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:21:27 UTC
Update Date2025-03-25 01:01:36 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02250421
Frequency0.5
Structure
Chemical FormulaC8H6O7
Molecular Mass214.0114
SMILESO=C(O)Cc1oc(C(=O)O)cc1C(=O)O
InChI KeyJGMBALUOUVCZJE-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass tricarboxylic acids and derivatives
Direct Parent tricarboxylic acids and derivatives
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids
  • furan-3-carboxylic acids
  • furoic acids
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organic oxides
  • oxacyclic compounds
  • Substituents
  • furan
  • carbonyl group
  • furoic acid or derivatives
  • furan-3-carboxylic acid
  • carboxylic acid
  • aromatic heteromonocyclic compound
  • heteroaromatic compound
  • tricarboxylic acid or derivatives
  • furoic acid
  • oxacycle
  • organic oxide
  • organic oxygen compound
  • hydrocarbon derivative
  • furan-3-carboxylic acid or derivatives
  • organoheterocyclic compound
  • organooxygen compound