Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 04:14:04 UTC
Update Date2025-03-21 23:11:24 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00660423
Frequency2.4
Structure
Chemical FormulaC6H9N3
Molecular Mass123.0796
SMILESCn1cnc2c1CCN2
InChI KeyNKFHHVMQOWDWDT-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass amines
Direct Parent secondary alkylarylamines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidazoles
  • imidolactams
  • n-substituted imidazoles
  • organopnictogen compounds
  • Substituents
  • azacycle
  • heteroaromatic compound
  • secondary aliphatic/aromatic amine
  • aromatic heteropolycyclic compound
  • imidazole
  • organopnictogen compound
  • hydrocarbon derivative
  • imidolactam
  • organoheterocyclic compound
  • azole
  • n-substituted imidazole