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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 16:29:51 UTC
Update Date2025-03-25 01:27:20 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02408374
Frequency0.5
Structure
Chemical FormulaC6H9N2O2+
Molecular Mass141.0659
SMILESCc1[nH]c(C(=O)O)c[n+]1C
InChI KeyOVQYUZCIUNHTEK-UHFFFAOYSA-O
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
  • carbonylimidazoles
  • carboxylic acids
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidazoles
  • monocarboxylic acids and derivatives
  • n-substituted imidazoles
  • organic cations
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • vinylogous amides
  • Substituents
  • vinylogous amide
  • carbonyl group
  • carboxylic acid
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • carboxylic acid derivative
  • 1,2,4-trisubstituted-imidazole
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • imidazole-4-carbonyl group
  • organic nitrogen compound
  • organic cation
  • organooxygen compound
  • n-substituted imidazole