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Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:36:55 UTC
Update Date2025-03-21 17:57:30 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00008268
Frequency594.1
Structure
Chemical FormulaC8H16NO3+
Molecular Mass174.1125
SMILESC[N+]1(C)CC(O)CCC1C(=O)O
InChI KeyVBBQURXYUHHBEZ-UHFFFAOYSA-O
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent alpha amino acids
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • 1,2-aminoalcohols
  • amines
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic cations
  • organic oxides
  • organic salts
  • organopnictogen compounds
  • piperidinecarboxylic acids
  • piperidines
  • secondary alcohols
  • tetraalkylammonium salts
  • Substituents
  • carbonyl group
  • carboxylic acid
  • organic oxide
  • aliphatic heteromonocyclic compound
  • alpha-amino acid
  • organonitrogen compound
  • organopnictogen compound
  • piperidinecarboxylic acid
  • organic cation
  • organic salt
  • piperidine
  • organoheterocyclic compound
  • alcohol
  • tetraalkylammonium salt
  • azacycle
  • 1,2-aminoalcohol
  • quaternary ammonium salt
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine
  • organooxygen compound