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Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:39:01 UTC
Update Date2025-03-21 17:58:15 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00013233
Frequency370.5
Structure
Chemical FormulaC10H11NO4
Molecular Mass209.0688
SMILESO=C(O)CCNC(=O)c1ccccc1O
InChI KeyQFHIOEUDLWISBO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent beta amino acids and derivatives
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • benzamides
  • benzoyl derivatives
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • salicylamides
  • secondary carboxylic acid amides
  • vinylogous acids
  • Substituents
  • monocyclic benzene moiety
  • carbonyl group
  • carboxylic acid
  • benzoyl
  • 1-hydroxy-2-unsubstituted benzenoid
  • benzamide
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • benzoic acid or derivatives
  • 1-hydroxy-4-unsubstituted benzenoid
  • carboxamide group
  • beta amino acid or derivatives
  • salicylamide
  • aromatic homomonocyclic compound
  • secondary carboxylic acid amide
  • vinylogous acid
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • salicylic acid or derivatives
  • phenol
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • organooxygen compound