Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 02:09:57 UTC
Update Date2025-03-21 20:49:05 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00366583
Frequency5.1
Structure
Chemical FormulaC5H9N5
Molecular Mass139.0858
SMILESNCc1cnc(N)nc1N
InChI KeyGSCPVFNKSWRDMO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdiazines
Subclass pyrimidines and pyrimidine derivatives
Direct Parent pyrimidines and pyrimidine derivatives
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidolactams
  • monoalkylamines
  • organopnictogen compounds
  • Substituents
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • pyrimidine
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • primary amine
  • organic nitrogen compound
  • imidolactam
  • amine