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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 11:10:39 UTC
Update Date2025-03-24 21:03:50 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01659482
Frequency0.8
Structure
Chemical FormulaC8H13NO
Molecular Mass139.0997
SMILESC=CC1C(O)C2CC1N2C
InChI KeyBMUUUZLFCLVTPJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrrolidines
Subclass n-alkylpyrrolidines
Direct Parent n-alkylpyrrolidines
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • 1,2-aminoalcohols
  • azacyclic compounds
  • azetidines
  • cyclic alcohols and derivatives
  • hydrocarbon derivatives
  • organopnictogen compounds
  • secondary alcohols
  • trialkylamines
  • Substituents
  • alcohol
  • azacycle
  • n-alkylpyrrolidine
  • 1,2-aminoalcohol
  • tertiary aliphatic amine
  • cyclic alcohol
  • azetidine
  • aliphatic heteropolycyclic compound
  • organic oxygen compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine
  • tertiary amine
  • organooxygen compound