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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:16:41 UTC
Update Date2025-03-25 00:59:48 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02239354
Frequency0.5
Structure
Chemical FormulaC8H10N2O4
Molecular Mass198.0641
SMILESCn1cc(CC(=O)O)nc1CC(=O)O
InChI KeyGIXYWGWZLAUZTH-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazoles
Subclass imidazoles
Direct Parent 1,2,4-trisubstituted imidazoles
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids
  • dicarboxylic acids and derivatives
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidazoles
  • n-substituted imidazoles
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • carbonyl group
  • carboxylic acid
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • carboxylic acid derivative
  • 1,2,4-trisubstituted-imidazole
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • dicarboxylic acid or derivatives
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • n-substituted imidazole