Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:17:03 UTC
Update Date2025-03-21 18:34:56 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00103099
Frequency26.4
Structure
Chemical FormulaC11H21NO2
Molecular Mass199.1572
SMILESCN(C)CCOC(=O)C1CCCCC1
InChI KeyXSJHJJIPYMDNLZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass carboxylic acid derivatives
Direct Parent carboxylic acid esters
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • amino acids and derivatives
  • carbonyl compounds
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • trialkylamines
  • Substituents
  • carbonyl group
  • amino acid or derivatives
  • tertiary aliphatic amine
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • organonitrogen compound
  • aliphatic homomonocyclic compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine
  • tertiary amine
  • organooxygen compound