Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:37:43 UTC
Update Date2025-03-25 00:45:39 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02150462
Frequency0.5
Structure
Chemical FormulaC8H9N3O
Molecular Mass163.0746
SMILESCc1nc2c(C)c[nH]c2c(=O)[nH]1
InChI KeyAQKYVDVLRLCCQE-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrrolopyrimidines
Subclass pyrrolopyrimidines
Direct Parent pyrrolopyrimidines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • lactams
  • organic oxides
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • pyrimidones
  • pyrroles
  • Substituents
  • lactam
  • azacycle
  • heteroaromatic compound
  • pyrimidone
  • pyrimidine
  • pyrrolopyrimidine
  • organic oxide
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • pyrrole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound