Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 03:23:21 UTC
Update Date2025-03-21 22:17:17 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00540609
Frequency3.1
Structure
Chemical FormulaC6H13NO2
Molecular Mass131.0946
SMILESCCCC(=O)OCCN
InChI KeyYSWFMQGCLBXBHU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classfatty acyls
Subclass fatty acid esters
Direct Parent fatty acid esters
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acid esters
  • hydrocarbon derivatives
  • monoalkylamines
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid derivative
  • fatty acid ester
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound