Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 13:02:26 UTC
Update Date2025-03-24 21:53:45 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01925181
Frequency0.6
Structure
Chemical FormulaC6H14N3+
Molecular Mass128.1182
SMILESC[N+]1(C)CCCN=C1N
InChI KeyPUJBUHLBLCZJKN-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdiazines
Subclass pyrimidines and pyrimidine derivatives
Direct Parent hydropyrimidines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • carboximidamides
  • guanidines
  • hydrocarbon derivatives
  • organic cations
  • organopnictogen compounds
  • Substituents
  • 1,4,5,6-tetrahydropyrimidine
  • azacycle
  • guanidine
  • carboximidamide
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • hydropyrimidine
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organic cation