Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:17:42 UTC
Update Date2025-03-25 01:00:14 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02241725
Frequency0.5
Structure
Chemical FormulaC8H12N6O
Molecular Mass208.1073
SMILESCC(O)CNc1nc2ncnc(N)c2[nH]1
InChI KeyVRWDBDPSQCCNRH-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classimidazopyrimidines
Subclass purines and purine derivatives
Direct Parent purines and purine derivatives
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidazoles
  • imidolactams
  • organopnictogen compounds
  • primary amines
  • pyrimidines and pyrimidine derivatives
  • secondary alcohols
  • secondary alkylarylamines
  • Substituents
  • alcohol
  • azacycle
  • heteroaromatic compound
  • secondary amine
  • secondary aliphatic/aromatic amine
  • pyrimidine
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • imidazole
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • primary amine
  • purine
  • organic nitrogen compound
  • imidolactam
  • amine
  • organooxygen compound
  • azole