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Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:44:51 UTC
Update Date2025-03-21 18:00:17 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00026303
Frequency193.0
Structure
Chemical FormulaC10H13N5O2
Molecular Mass235.1069
SMILESCC(=O)NCCc1c[nH]c2[nH]c(=N)[nH]c(=O)c12
InChI KeyGYGMEMVJDCADML-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrrolopyrimidines
Subclass pyrrolo[2,3-d]pyrimidines
Direct Parent pyrrolo[2,3-d]pyrimidines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • acetamides
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • lactams
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • pyrimidones
  • pyrroles
  • secondary carboxylic acid amides
  • vinylogous amides
    • Substituents
  • vinylogous amide
  • carbonyl group
  • lactam
  • azacycle
  • heteroaromatic compound
  • pyrimidone
  • carboxamide group
  • carboxylic acid derivative
  • pyrimidine
  • secondary carboxylic acid amide
  • organic oxide
  • pyrrolo[2,3-d]pyrimidine
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • pyrrole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • acetamide
  • organooxygen compound