Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 16:30:27 UTC
Update Date2025-03-25 01:27:33 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02409776
Frequency0.5
Structure
Chemical FormulaC6H7N3
Molecular Mass121.064
SMILESc1cnc2c(n1)CCN2
InChI KeyIKODPGBBYKAAFB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrrolopyrazines
Subclass pyrrolopyrazines
Direct Parent pyrrolopyrazines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidolactams
  • organopnictogen compounds
  • pyrazines
  • pyrroles
  • secondary alkylarylamines
  • Substituents
  • azacycle
  • heteroaromatic compound
  • secondary amine
  • secondary aliphatic/aromatic amine
  • aromatic heteropolycyclic compound
  • pyrazine
  • pyrrole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • imidolactam
  • pyrrolopyrazine
  • amine