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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:30:07 UTC
Update Date2025-03-21 18:41:26 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00134319
Frequency18.7
Structure
Chemical FormulaC7H9N3O4
Molecular Mass199.0593
SMILESNC(=O)c1cn(CC(O)C(=O)O)cn1
InChI KeyFCZICFQTLXHFLR-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass carboxylic acid derivatives
Direct Parent 2-heteroaryl carboxamides
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • alpha hydroxy acids and derivatives
  • azacyclic compounds
  • carbonyl compounds
  • carbonylimidazoles
  • carboxylic acids
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidazoles
  • monocarboxylic acids and derivatives
  • n-substituted imidazoles
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • primary carboxylic acid amides
  • secondary alcohols
  • vinylogous amides
  • Substituents
  • primary carboxylic acid amide
  • carbonyl group
  • carboxylic acid
  • aromatic heteromonocyclic compound
  • alpha-hydroxy acid
  • 2-heteroaryl carboxamide
  • organic oxide
  • imidazole
  • organonitrogen compound
  • organopnictogen compound
  • imidazole-4-carbonyl group
  • organoheterocyclic compound
  • azole
  • n-substituted imidazole
  • alcohol
  • vinylogous amide
  • azacycle
  • heteroaromatic compound
  • hydroxy acid
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound