Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:41:55 UTC
Update Date2025-03-25 00:47:11 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02160016
Frequency0.5
Structure
Chemical FormulaC9H11N5O
Molecular Mass205.0964
SMILESO=c1[nH]c(C2CCCN2)nc2nc[nH]c12
InChI KeyJGXCKLLKHKFZJC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classimidazopyrimidines
Subclass purines and purine derivatives
Direct Parent hypoxanthines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • dialkylamines
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidazoles
  • lactams
  • organic oxides
  • organooxygen compounds
  • organopnictogen compounds
  • purines and purine derivatives
  • pyrimidones
  • pyrrolidines
  • Substituents
  • secondary aliphatic amine
  • lactam
  • azacycle
  • heteroaromatic compound
  • pyrimidone
  • secondary amine
  • pyrimidine
  • organic oxide
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • imidazole
  • organonitrogen compound
  • organopnictogen compound
  • hypoxanthine
  • hydrocarbon derivative
  • organic nitrogen compound
  • pyrrolidine
  • organooxygen compound
  • amine
  • azole