Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:05:24 UTC
Update Date2025-03-21 18:28:59 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00075105
Frequency39.4
Structure
Chemical FormulaC9H18NO2+
Molecular Mass172.1332
SMILESCC1CCCC(C(=O)O)[N+]1(C)C
InChI KeyMCBDYHOLAKGGAI-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
  • amines
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic cations
  • organic oxides
  • organic salts
  • organopnictogen compounds
  • piperidinecarboxylic acids
  • piperidines
  • tetraalkylammonium salts
  • Substituents
  • carbonyl group
  • carboxylic acid
  • tetraalkylammonium salt
  • azacycle
  • quaternary ammonium salt
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • alpha-amino acid
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • piperidinecarboxylic acid
  • organic nitrogen compound
  • organic cation
  • organic salt
  • piperidine
  • amine
  • organoheterocyclic compound
  • organooxygen compound