Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:19:03 UTC
Update Date2025-03-21 18:35:56 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00108030
Frequency24.8
Structure
Chemical FormulaC9H15NO
Molecular Mass153.1154
SMILESC=CC1(O)CC2CCC1N2C
InChI KeyALEDAFSVBWGELW-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrrolidines
Subclass n-alkylpyrrolidines
Direct Parent n-alkylpyrrolidines
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • cyclic alcohols and derivatives
  • hydrocarbon derivatives
  • organopnictogen compounds
  • tertiary alcohols
  • trialkylamines
  • Substituents
  • alcohol
  • azacycle
  • n-alkylpyrrolidine
  • tertiary aliphatic amine
  • cyclic alcohol
  • aliphatic heteropolycyclic compound
  • tertiary alcohol
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine
  • tertiary amine
  • organooxygen compound