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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:14:39 UTC
Update Date2025-03-25 00:59:03 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02234797
Frequency0.5
Structure
Chemical FormulaC7H9N5O2S
Molecular Mass227.0477
SMILESCNc1nc(S(C)(=O)=O)nc2[nH]cnc12
InChI KeyRNWDVRRPLGBWIG-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
  • organic oxides
  • organopnictogen compounds
  • pyrimidines and pyrimidine derivatives
  • secondary alkylarylamines
  • sulfones
  • Substituents
  • azacycle
  • heteroaromatic compound
  • secondary amine
  • organosulfur compound
  • secondary aliphatic/aromatic amine
  • pyrimidine
  • organic oxide
  • sulfonyl
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • imidazole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • purine
  • organic nitrogen compound
  • imidolactam
  • amine
  • sulfone
  • azole