Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:59:04 UTC
Update Date2025-03-25 00:53:20 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02199109
Frequency0.5
Structure
Chemical FormulaC21H42NO4+
Molecular Mass372.3108
SMILESCCCCCCCCCCCCCC(CCC(=O)O)OC(=O)[N+](C)(C)C
InChI KeyZOFIYZOMTJDAEZ-UHFFFAOYSA-O
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classfatty acyls
Subclass fatty acids and conjugates
Direct Parent long-chain fatty acids
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • amino fatty acids
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • hydroxy fatty acids
  • monocarboxylic acids and derivatives
  • organic carbonic acids and derivatives
  • organic cations
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • long-chain fatty acid
  • carbonic acid derivative
  • carboxylic acid
  • carboxylic acid derivative
  • amino fatty acid
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • hydroxy fatty acid
  • organic nitrogen compound
  • organic cation
  • organooxygen compound