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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 02:27:33 UTC
Update Date2025-03-21 20:56:18 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00408167
Frequency4.4
Structure
Chemical FormulaC6H11NO
Molecular Mass113.0841
SMILESCN1C2CC(O)C1C2
InChI KeyKBWRBUXTYATXNM-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