Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 08:15:58 UTC
Update Date2025-03-24 23:03:03 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01242392
Frequency1.1
Structure
Chemical FormulaC4H5N5
Molecular Mass123.0545
SMILESNc1ncc2[nH][nH]c2n1
InChI KeyYRKDOTFLSDGYTP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdiazines
Subclass pyrimidines and pyrimidine derivatives
Direct Parent pyrimidines and pyrimidine derivatives
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organopnictogen compounds
  • primary amines
  • Substituents
  • azacycle
  • aromatic heteropolycyclic compound
  • heteroaromatic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • amine
  • pyrimidine