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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:05:13 UTC
Update Date2025-03-25 00:55:39 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02213466
Frequency0.5
Structure
Chemical FormulaC15H21N7OS
Molecular Mass347.1528
SMILESCN(C)Cc1ccc(CSCCNc2nc(N)nc3nc[nH]c23)o1
InChI KeyZBLBSEGJXDTFMA-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
  • aralkylamines
  • azacyclic compounds
  • dialkylthioethers
  • furans
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidazoles
  • imidolactams
  • organooxygen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • primary amines
  • pyrimidines and pyrimidine derivatives
  • secondary alkylarylamines
  • sulfenyl compounds
  • trialkylamines
  • Substituents
  • furan
  • organosulfur compound
  • aralkylamine
  • pyrimidine
  • aromatic heteropolycyclic compound
  • imidazole
  • organonitrogen compound
  • organopnictogen compound
  • imidolactam
  • tertiary amine
  • azole
  • sulfenyl compound
  • azacycle
  • dialkylthioether
  • heteroaromatic compound
  • tertiary aliphatic amine
  • secondary amine
  • secondary aliphatic/aromatic amine
  • oxacycle
  • organic oxygen compound
  • thioether
  • hydrocarbon derivative
  • primary amine
  • purine
  • organic nitrogen compound
  • amine
  • organooxygen compound