Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:02:05 UTC
Update Date2025-03-21 18:07:06 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00067134
Frequency45.3
Structure
Chemical FormulaC9H6O6
Molecular Mass210.0164
SMILESO=C(O)c1ccc(C(=O)O)c(C(=O)O)c1
InChI KeyARCGXLSVLAOJQL-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 homomonocyclic compounds
Alternative Parents
  • 1-carboxy-2-haloaromatic compounds
  • benzoic acids
  • benzoyl derivatives
  • hydrocarbon derivatives
  • organic oxides
  • organooxygen compounds
  • Substituents
  • monocyclic benzene moiety
  • carboxylic acid
  • benzoyl
  • benzoic acid or derivatives
  • tricarboxylic acid or derivatives
  • aromatic homomonocyclic compound
  • organic oxide
  • organic oxygen compound
  • hydrocarbon derivative
  • benzenoid
  • 1-carboxy-2-haloaromatic compound
  • benzoic acid
  • organooxygen compound