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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:25:10 UTC
Update Date2025-03-21 18:38:49 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00122760
Frequency21.0
Structure
Chemical FormulaC11H13NO4
Molecular Mass223.0845
SMILESO=C(O)C1CCN(C(=O)c2ccco2)CC1
InChI KeyGGWOZMNUCDKQIN-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpiperidines
Subclass piperidinecarboxylic acids and derivatives
Direct Parent piperidinecarboxylic acids
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 2-heteroaryl carboxamides
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids
  • furoic acid and derivatives
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • n-acylpiperidines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • tertiary carboxylic acid amides
    • Substituents
  • furan
  • carbonyl group
  • carboxylic acid
  • aromatic heteromonocyclic compound
  • carboxylic acid derivative
  • 2-heteroaryl carboxamide
  • organic oxide
  • tertiary carboxylic acid amide
  • organonitrogen compound
  • organopnictogen compound
  • piperidinecarboxylic acid
  • furoic acid or derivatives
  • azacycle
  • heteroaromatic compound
  • carboxamide group
  • oxacycle
  • n-acyl-piperidine
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound