Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:45:17 UTC
Update Date2025-03-25 00:48:21 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02167697
Frequency0.5
Structure
Chemical FormulaC9H11N5OS
Molecular Mass237.0684
SMILESCC(C)Sc1cnc2nc(N)[nH]c(=O)c2n1
InChI KeyQRINLZOPQYGLHD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpteridines and derivatives
Subclass pterins and derivatives
Direct Parent pterins and derivatives
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • alkylarylthioethers
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • lactams
  • organic oxides
  • organooxygen compounds
  • organopnictogen compounds
  • primary amines
  • pyrazines
  • pyrimidones
  • sulfenyl compounds
  • Substituents
  • lactam
  • pyrimidone
  • alkylarylthioether
  • organosulfur compound
  • aryl thioether
  • pyrimidine
  • organic oxide
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • pterin
  • sulfenyl compound
  • azacycle
  • heteroaromatic compound
  • organic oxygen compound
  • thioether
  • pyrazine
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • amine
  • organooxygen compound