Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:58:34 UTC
Update Date2025-03-21 18:05:45 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00058775
Frequency130.2
Structure
Chemical FormulaC5H5N7O
Molecular Mass179.0556
SMILESNc1nnc2c(=O)[nH]c(N)nc2n1
InChI KeyAFXMGOQPEDAESL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdiazines
Subclass pyrimidines and pyrimidine derivatives
Direct Parent pyrimidones
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1,2,4-triazines
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • lactams
  • organic oxides
  • organooxygen compounds
  • organopnictogen compounds
  • primary amines
  • Substituents
  • lactam
  • azacycle
  • heteroaromatic compound
  • pyrimidone
  • organic oxide
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • triazine
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • 1,2,4-triazine
  • amine
  • organooxygen compound