Hmdb loader

Showing information for DMID02158058

Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:41:02 UTC
Update Date2025-03-25 00:46:54 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02158058
Frequency0.5
Structure
Chemical FormulaC13H21NO2
Molecular Mass223.1572
SMILESC=CC(C)C(=O)OC1CC2CCC(C1)N2C
InChI KeyFQHCNXGVUVNSDV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassalkaloids and derivatives
Classtropane alkaloids
Subclass tropane alkaloids
Direct Parent tropane alkaloids
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • amino acids and derivatives
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acid esters
  • fatty acid esters
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • n-alkylpyrrolidines
  • organic oxides
  • organopnictogen compounds
  • piperidines
  • trialkylamines
    • Substituents
  • fatty acyl
  • carbonyl group
  • amino acid or derivatives
  • carboxylic acid derivative
  • aliphatic heteropolycyclic compound
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • pyrrolidine
  • piperidine
  • tertiary amine
  • organoheterocyclic compound
  • azacycle
  • n-alkylpyrrolidine
  • tertiary aliphatic amine
  • fatty acid ester
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • hydrocarbon derivative
  • organic nitrogen compound
  • tropane alkaloid
  • amine
  • organooxygen compound