Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:36:20 UTC
Update Date2025-03-21 17:57:17 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00006890
Frequency1506.6
Structure
Chemical FormulaC6H6N6O2
Molecular Mass194.0552
SMILESNc1nc2[nH]c(N)nc(=O)c2c(=O)[nH]1
InChI KeyCSBOUIDSNHUYLW-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdiazines
Subclass pyrimidines and pyrimidine derivatives
Direct Parent pyrimidones
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • lactams
  • organic oxides
  • organooxygen compounds
  • organopnictogen compounds
  • primary amines
  • vinylogous amides
  • Substituents
  • vinylogous amide
  • lactam
  • azacycle
  • heteroaromatic compound
  • pyrimidone
  • organic oxide
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • amine
  • organooxygen compound