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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:40:30 UTC
Update Date2025-03-25 00:46:43 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02156926
Frequency0.5
Structure
Chemical FormulaC7H11NO2
Molecular Mass141.079
SMILESO=C1C(O)CN2CCCC12
InChI KeyIWLZALQZKLDRCR-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrrolizidines
Subclass pyrrolizidinones
Direct Parent pyrrolizidinones
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • hydrocarbon derivatives
  • ketones
  • n-alkylpyrrolidines
  • organic oxides
  • organopnictogen compounds
  • pyrrolidine-3-ones
  • secondary alcohols
  • trialkylamines
    • Substituents
  • alcohol
  • pyrrolizidinone
  • carbonyl group
  • azacycle
  • 3-pyrrolidone
  • n-alkylpyrrolidine
  • tertiary aliphatic amine
  • ketone
  • aliphatic heteropolycyclic compound
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • pyrrolidine
  • pyrrolidone
  • amine
  • tertiary amine
  • organooxygen compound