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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 10:53:56 UTC
Update Date2025-03-24 20:56:31 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01618934
Frequency0.8
Structure
Chemical FormulaC6H8N4
Molecular Mass136.0749
SMILESCn1ccc2[nH]c(N)nc21
InChI KeyMWDLNSJDNWIDBE-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrroles
Subclass substituted pyrroles
Direct Parent substituted pyrroles
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidazoles
  • n-methylpyrroles
  • organopnictogen compounds
  • primary amines
    • Substituents
  • n-methylpyrrole
  • azacycle
  • heteroaromatic compound
  • substituted pyrrole
  • aromatic heteropolycyclic compound
  • imidazole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • amine
  • azole