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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:46:21 UTC
Update Date2025-03-25 00:48:46 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02170098
Frequency0.5
Structure
Chemical FormulaC19H35NO6
Molecular Mass373.2464
SMILESCCCCCCCCCCCC=CC(=O)OC(C(=O)O)C(O)C(N)CO
InChI KeyRZKWEZAWDUBRMX-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent gamma amino acids and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • beta hydroxy acids and derivatives
  • carbonyl compounds
  • carboxylic acids
  • dicarboxylic acids and derivatives
  • enoate esters
  • fatty acid esters
  • hydrocarbon derivatives
  • hydroxy fatty acids
  • monoalkylamines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • primary alcohols
  • secondary alcohols
  • short-chain hydroxy acids and derivatives
  • Substituents
  • fatty acyl
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • short-chain hydroxy acid
  • gamma amino acid or derivatives
  • alpha,beta-unsaturated carboxylic ester
  • beta-hydroxy acid
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • hydroxy fatty acid
  • primary alcohol
  • enoate ester
  • alcohol
  • hydroxy acid
  • fatty acid ester
  • organic oxygen compound
  • carboxylic acid ester
  • secondary alcohol
  • dicarboxylic acid or derivatives
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound