Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:14:43 UTC
Update Date2025-03-21 18:33:44 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00097374
Frequency54.8
Structure
Chemical FormulaC7H7N3O
Molecular Mass149.0589
SMILESCn1ccc2c(O)ncnc21
InChI KeyJWXXZAHMLYLRBC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrrolopyrimidines
Subclass pyrrolo[2,3-d]pyrimidines
Direct Parent pyrrolo[2,3-d]pyrimidines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • hydroxypyrimidines
  • n-methylpyrroles
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • substituted pyrroles
  • Substituents
  • n-methylpyrrole
  • azacycle
  • heteroaromatic compound
  • hydroxypyrimidine
  • substituted pyrrole
  • pyrimidine
  • pyrrolo[2,3-d]pyrimidine
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • pyrrole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound