Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:43:46 UTC
Update Date2025-03-25 00:47:48 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02164191
Frequency0.5
Structure
Chemical FormulaC10H17NO3
Molecular Mass199.1208
SMILESCC(O)C(=O)OC1CC2CC(C1)N2C
InChI KeyUQPCONINYGWPDT-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpiperidines
Subclass piperidines
Direct Parent piperidines
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • amino acids and derivatives
  • azacyclic compounds
  • azetidines
  • carbonyl compounds
  • carboxylic acid esters
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • secondary alcohols
  • trialkylamines
  • Substituents
  • alcohol
  • carbonyl group
  • azacycle
  • amino acid or derivatives
  • tertiary aliphatic amine
  • carboxylic acid derivative
  • azetidine
  • aliphatic heteropolycyclic compound
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • piperidine
  • amine
  • tertiary amine
  • organooxygen compound