Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:05:18 UTC
Update Date2025-03-25 00:55:41 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02213632
Frequency0.5
Structure
Chemical FormulaC9H15NO3
Molecular Mass185.1052
SMILESCOC(=O)C1(O)CC2CCN1CC2
InChI KeyHODXTDOIUOCLOM-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent alpha amino acid esters
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • alkanolamines
  • alpha amino acids
  • azacyclic compounds
  • carbonyl compounds
  • hydrocarbon derivatives
  • methyl esters
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • piperidinecarboxylic acids
  • piperidines
  • quinuclidines
  • Substituents
  • carbonyl group
  • azacycle
  • alpha-amino acid ester
  • quinuclidine
  • aliphatic heteropolycyclic compound
  • organic oxide
  • monocarboxylic acid or derivatives
  • methyl ester
  • organic oxygen compound
  • carboxylic acid ester
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • hydrocarbon derivative
  • piperidinecarboxylic acid
  • organic nitrogen compound
  • piperidine
  • organoheterocyclic compound
  • organooxygen compound
  • alkanolamine