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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:52:22 UTC
Update Date2025-03-25 00:50:57 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02183873
Frequency0.5
Structure
Chemical FormulaC7H13NO2
Molecular Mass143.0946
SMILESO=C1CCN(CCCO)C1
InChI KeyNQECKELDGYYNHH-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrrolidines
Subclass pyrrolidones
Direct Parent pyrrolidine-3-ones
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • 1,3-aminoalcohols
  • alcohols and polyols
  • azacyclic compounds
  • cyclic ketones
  • hydrocarbon derivatives
  • n-alkylpyrrolidines
  • organic oxides
  • organopnictogen compounds
  • trialkylamines
    • Substituents
  • alcohol
  • carbonyl group
  • 1,3-aminoalcohol
  • azacycle
  • 3-pyrrolidone
  • n-alkylpyrrolidine
  • tertiary aliphatic amine
  • cyclic ketone
  • ketone
  • organic oxide
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine
  • tertiary amine
  • organooxygen compound