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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:16:17 UTC
Update Date2025-03-25 00:59:39 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02238487
Frequency0.5
Structure
Chemical FormulaC15H10NO4+
Molecular Mass268.0604
SMILESO=C(O)c1cc(=O)c2[o+]c(-c3ccccc3)ccc2[nH]1
InChI KeyGXCQJOULTQQPJQ-UHFFFAOYSA-O
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyranopyridines
Subclass pyranopyridines
Direct Parent pyranopyridines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 2-halopyridines
  • azacyclic compounds
  • benzene and substituted derivatives
  • carboxylic acids
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • hydroxypyridines
  • monocarboxylic acids and derivatives
  • organic cations
  • organic oxides
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • polyhalopyridines
  • pyridine-2-carboxylic acids
  • vinylogous amides
  • Substituents
  • pyridine carboxylic acid or derivatives
  • monocyclic benzene moiety
  • carboxylic acid
  • polyhalopyridine
  • carboxylic acid derivative
  • organic oxide
  • pyridine-2-carboxylic acid
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • 2-halopyridine
  • organic cation
  • vinylogous amide
  • azacycle
  • heteroaromatic compound
  • hydroxypyridine
  • oxacycle
  • monocarboxylic acid or derivatives
  • pyridine
  • organic oxygen compound
  • pyridine carboxylic acid
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • pyranopyridine
  • organooxygen compound