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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 04:49:27 UTC
Update Date2025-03-24 14:04:01 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00745324
Frequency2.0
Structure
Chemical FormulaC7H11NO2
Molecular Mass141.079
SMILESCN1C2CC(=O)C1C(O)C2
InChI KeyIXDWAYYTWQZBHS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrrolidines
Subclass pyrrolidones
Direct Parent pyrrolidine-3-ones
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • cyclic alcohols and derivatives
  • hydrocarbon derivatives
  • ketones
  • n-alkylpyrrolidines
  • organic oxides
  • organopnictogen compounds
  • secondary alcohols
  • trialkylamines
    • Substituents
  • alcohol
  • carbonyl group
  • azacycle
  • 3-pyrrolidone
  • n-alkylpyrrolidine
  • tertiary aliphatic amine
  • cyclic alcohol
  • ketone
  • aliphatic heteropolycyclic compound
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine
  • tertiary amine
  • organooxygen compound