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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:09:07 UTC
Update Date2025-03-21 18:31:02 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00084056
Frequency34.2
Structure
Chemical FormulaC8H9NO4
Molecular Mass183.0532
SMILESCNC(=O)c1cc(O)c(O)c(O)c1
InChI KeyLZCHRYJYWPHMPX-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenols
Subclass benzenetriols and derivatives
Direct Parent pyrogallols and derivatives
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • benzamides
  • benzoyl derivatives
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • secondary carboxylic acid amides
  • Substituents
  • monocyclic benzene moiety
  • pyrogallol derivative
  • benzoyl
  • 1-hydroxy-2-unsubstituted benzenoid
  • benzoic acid or derivatives
  • 1-hydroxy-4-unsubstituted benzenoid
  • carboxamide group
  • carboxylic acid derivative
  • benzamide
  • aromatic homomonocyclic compound
  • secondary carboxylic acid amide
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound