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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:40:49 UTC
Update Date2025-03-25 00:46:49 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02157608
Frequency0.5
Structure
Chemical FormulaC7H13NO2+
Molecular Mass143.0941
SMILESO=C(O)CC[N+]1CCCC1
InChI KeyXPENAHIGOLKLJH-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrrolidines
Subclass n-alkylpyrrolidines
Direct Parent n-alkylpyrrolidines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic cations
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
    • Substituents
  • carbonyl group
  • carboxylic acid
  • azacycle
  • n-alkylpyrrolidine
  • carboxylic acid derivative
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organic cation
  • organooxygen compound