Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 03:24:28 UTC
Update Date2025-03-21 22:17:49 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00543340
Frequency3.1
Structure
Chemical FormulaC8H17N2+
Molecular Mass141.1386
SMILESC[N+](C)(C)CC1=NCCC1
InChI KeyPBVFNPMYXBJTSV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrrolines
Subclass pyrrolines
Direct Parent pyrrolines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • amines
  • azacyclic compounds
  • hydrocarbon derivatives
  • ketimines
  • organic cations
  • organic salts
  • organopnictogen compounds
  • tetraalkylammonium salts
  • Substituents
  • ketimine
  • tetraalkylammonium salt
  • azacycle
  • imine
  • quaternary ammonium salt
  • pyrroline
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organic cation
  • organic salt
  • amine