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Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:39:51 UTC
Update Date2025-03-21 17:58:32 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00015103
Frequency289.2
Structure
Chemical FormulaC8H9NO4
Molecular Mass183.0532
SMILESO=C(O)C(O)Cn1ccccc1=O
InChI KeyUMMIQRXPKDWQQP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyridines and derivatives
Subclass hydropyridines
Direct Parent pyridinones
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • alpha hydroxy acids and derivatives
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • hydroxypyridines
  • lactams
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary alcohols
  • Substituents
  • alcohol
  • carbonyl group
  • lactam
  • carboxylic acid
  • aromatic heteromonocyclic compound
  • azacycle
  • alpha-hydroxy acid
  • heteroaromatic compound
  • hydroxypyridine
  • hydroxy acid
  • carboxylic acid derivative
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • pyridinone
  • organooxygen compound