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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:38:04 UTC
Update Date2025-03-25 00:45:47 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02151289
Frequency0.5
Structure
Chemical FormulaC7H8N6O2
Molecular Mass208.0709
SMILESCn1c(=O)[nH]c2c(N)c(C(N)=O)nnc21
InChI KeyRGLGGWQAMGLUDS-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 heteropolycyclic compounds
Alternative Parents
  • amino acids and derivatives
  • azacyclic compounds
  • carboxylic acids and derivatives
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidazoles
  • n-substituted imidazoles
  • organic carbonic acids and derivatives
  • organic oxides
  • organooxygen compounds
  • organopnictogen compounds
  • primary amines
  • primary carboxylic acid amides
  • pyridazines and derivatives
  • vinylogous amides
  • Substituents
  • primary carboxylic acid amide
  • amino acid or derivatives
  • 2-heteroaryl carboxamide
  • organic oxide
  • aromatic heteropolycyclic compound
  • imidazole
  • organonitrogen compound
  • organopnictogen compound
  • organoheterocyclic compound
  • azole
  • n-substituted imidazole
  • vinylogous amide
  • carbonic acid derivative
  • azacycle
  • heteroaromatic compound
  • organic oxygen compound
  • pyridazine
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • amine
  • organooxygen compound