Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:15:54 UTC
Update Date2025-03-25 00:59:31 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02237616
Frequency0.5
Structure
Chemical FormulaC5H6N6O
Molecular Mass166.0603
SMILESNc1cc(=O)n2[nH]c(N)nc2n1
InChI KeyPBXXNZHAPNXEJP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classtriazolopyrimidines
Subclass triazolopyrimidines
Direct Parent triazolopyrimidines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidolactams
  • lactams
  • organic oxides
  • organooxygen compounds
  • organopnictogen compounds
  • primary amines
  • pyrimidones
  • triazoles
  • vinylogous amides
  • Substituents
  • vinylogous amide
  • triazole
  • lactam
  • 1,2,4-triazole
  • azacycle
  • heteroaromatic compound
  • pyrimidone
  • pyrimidine
  • organic oxide
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • imidolactam
  • triazolopyrimidine
  • amine
  • organooxygen compound
  • azole