Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 07:03:13 UTC
Update Date2025-03-24 19:52:36 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01064914
Frequency1.3
Structure
Chemical FormulaC4H4N6
Molecular Mass136.0497
SMILESNc1ncc2[nH]nnc2n1
InChI KeyVJCQEPWQSBKWTE-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
  • organopnictogen compounds
  • primary amines
  • pyrimidines and pyrimidine derivatives
  • triazoles
  • Substituents
  • triazole
  • azacycle
  • heteroaromatic compound
  • pyrimidine
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • 1,2,3-triazole
  • triazolopyrimidine
  • amine
  • azole