Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 03:27:09 UTC
Update Date2025-03-21 22:18:58 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00549646
Frequency3.0
Structure
Chemical FormulaC5H8N4
Molecular Mass124.0749
SMILESCNc1ncnc(C)n1
InChI KeyVCHXFEBIWFGFOI-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classtriazines
Subclass aminotriazines
Direct Parent n-aliphatic s-triazines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • halo-s-triazines
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organopnictogen compounds
  • secondary alkylarylamines
  • Substituents
  • n-aliphatic s-triazine
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • secondary amine
  • secondary aliphatic/aromatic amine
  • halo-s-triazine
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • 1,3,5-triazine
  • organic nitrogen compound
  • amine