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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:11:44 UTC
Update Date2025-03-21 18:32:18 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00090135
Frequency31.3
Structure
Chemical FormulaC10H9NO5
Molecular Mass223.0481
SMILESO=C1CC(C(=O)O)c2cc(O)c(O)cc2N1
InChI KeyGMYYWXLVBFCZHI-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classquinolines and derivatives
Subclass quinoline carboxylic acids
Direct Parent quinoline carboxylic acids
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • azacyclic compounds
  • benzenoids
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • hydroquinolines
  • hydroquinolones
  • lactams
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary carboxylic acid amides
  • Substituents
  • carbonyl group
  • lactam
  • carboxylic acid
  • 1-hydroxy-2-unsubstituted benzenoid
  • quinoline-4-carboxylic acid
  • carboxylic acid derivative
  • organic oxide
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • tetrahydroquinoline
  • quinolone
  • tetrahydroquinolone
  • azacycle
  • carboxamide group
  • secondary carboxylic acid amide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • organooxygen compound