Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 06:29:48 UTC
Update Date2025-03-24 17:50:41 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00986293
Frequency1.4
Structure
Chemical FormulaC6H9N3
Molecular Mass123.0796
SMILESCNc1ncc(C)cn1
InChI KeyHDCAHRAHYJJDSU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass amines
Direct Parent secondary alkylarylamines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organopnictogen compounds
  • pyrimidines and pyrimidine derivatives
  • Substituents
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • secondary aliphatic/aromatic amine
  • pyrimidine
  • organopnictogen compound
  • hydrocarbon derivative
  • organoheterocyclic compound