Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 08:11:23 UTC
Update Date2025-03-24 22:34:19 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01231255
Frequency1.1
Structure
Chemical FormulaC6H15N2O+
Molecular Mass131.1179
SMILESC[N+]1(C)CC(O)CC1N
InChI KeyRCJBLBMXUQGMIZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrrolidines
Subclass n-alkylpyrrolidines
Direct Parent n-alkylpyrrolidines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • aminals
  • azacyclic compounds
  • hydrocarbon derivatives
  • monoalkylamines
  • organic cations
  • organic salts
  • organopnictogen compounds
  • secondary alcohols
  • tetraalkylammonium salts
  • Substituents
  • alcohol
  • tetraalkylammonium salt
  • azacycle
  • n-alkylpyrrolidine
  • aminal
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organic cation
  • organic salt
  • organooxygen compound