Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 02:46:46 UTC
Update Date2025-03-21 21:57:53 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00454021
Frequency3.9
Structure
Chemical FormulaC6H4O4
Molecular Mass140.011
SMILESCc1c(C(=O)O)c(=O)c1=O
InChI KeyAERJIHAJPJWRHL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass carboxylic acids
Direct Parent 1-carboxy-2-haloaromatic compounds
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • cyclic ketones
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organooxygen compounds
  • Substituents
  • aromatic homomonocyclic compound
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • hydrocarbon derivative
  • cyclic ketone
  • 1-carboxy-2-haloaromatic compound
  • organooxygen compound