Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 01:16:54 UTC
Update Date2025-03-21 19:09:26 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00243493
Frequency8.7
Structure
Chemical FormulaC4H6N4O
Molecular Mass126.0542
SMILESNc1ncc(O)c(N)n1
InChI KeyYQGHJCYLMLPCCB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdiazines
Subclass pyrimidines and pyrimidine derivatives
Direct Parent hydroxypyrimidines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidolactams
  • organooxygen compounds
  • organopnictogen compounds
  • primary amines
  • Substituents
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • hydroxypyrimidine
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • imidolactam
  • amine
  • organooxygen compound