Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:31:18 UTC
Update Date2025-03-21 18:41:58 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00137021
Frequency34.1
Structure
Chemical FormulaC5H4N4OS
Molecular Mass168.0106
SMILESO=c1nc(S)nc2[nH][nH]cc1-2
InChI KeySXRSXYWROQWSGJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrazolopyrimidines
Subclass pyrazolo[3,4-d]pyrimidines
Direct Parent pyrazolo[3,4-d]pyrimidines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • pyrazoles
  • pyrimidones
  • thiols
  • vinylogous amides
  • Substituents
  • pyrazolo[3,4-d]pyrimidine
  • vinylogous amide
  • azacycle
  • heteroaromatic compound
  • pyrimidone
  • arylthiol
  • organosulfur compound
  • pyrazole
  • pyrimidine
  • organic oxide
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • azole