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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:14:29 UTC
Update Date2025-03-25 00:59:01 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02234414
Frequency0.5
Structure
Chemical FormulaC8H14NO4+
Molecular Mass188.0917
SMILESC[N+]1(C)CC(=O)CC(O)(C(=O)O)C1
InChI KeyBWOZCKANYLXDDW-UHFFFAOYSA-O
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpiperidines
Subclass piperidinecarboxylic acids and derivatives
Direct Parent piperidinecarboxylic acids
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • alpha hydroxy acids and derivatives
  • amines
  • azacyclic compounds
  • carboxylic acids
  • cyclic ketones
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic cations
  • organic oxides
  • organic salts
  • organopnictogen compounds
  • piperidinones
  • tertiary alcohols
  • tetraalkylammonium salts
  • Substituents
  • carbonyl group
  • carboxylic acid
  • alpha-hydroxy acid
  • cyclic ketone
  • carboxylic acid derivative
  • ketone
  • organic oxide
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • piperidinone
  • piperidinecarboxylic acid
  • organic cation
  • organic salt
  • alcohol
  • tetraalkylammonium salt
  • azacycle
  • quaternary ammonium salt
  • hydroxy acid
  • tertiary alcohol
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine
  • organooxygen compound