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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:09:07 UTC
Update Date2025-03-25 00:57:04 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02222470
Frequency0.5
Structure
Chemical FormulaC10H9NO4
Molecular Mass207.0532
SMILESO=C1NC(c2ccc(O)cc2)C(O)=C1O
InChI KeyIDBGSFKCJFRJIC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrrolines
Subclass phenylpyrrolines
Direct Parent phenylpyrrolines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • azacyclic compounds
  • benzene and substituted derivatives
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • lactams
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • pyrroles
  • secondary carboxylic acid amides
  • vinylogous acids
    • Substituents
  • monocyclic benzene moiety
  • carbonyl group
  • lactam
  • aromatic heteromonocyclic compound
  • azacycle
  • 1-hydroxy-2-unsubstituted benzenoid
  • 2-phenylpyrroline
  • carboxamide group
  • carboxylic acid derivative
  • secondary carboxylic acid amide
  • vinylogous acid
  • organic oxide
  • organic oxygen compound
  • pyrrole
  • organonitrogen compound
  • organopnictogen compound
  • phenol
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • organooxygen compound