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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:18:21 UTC
Update Date2025-03-25 01:00:32 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02243208
Frequency0.5
Structure
Chemical FormulaC19H27NO7
Molecular Mass381.1788
SMILESCC(=O)NC1C(OC(=O)CCC(O)Cc2ccccc2)OC(C)C(O)C1O
InChI KeyZUQCSWUXXLHRIY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classfatty acyls
Subclass fatty acid esters
Direct Parent fatty acid esters
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • acetals
  • acetamides
  • benzene and substituted derivatives
  • carbonyl compounds
  • carboxylic acid esters
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • monosaccharides
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • oxanes
  • secondary alcohols
  • secondary carboxylic acid amides
  • Substituents
  • monocyclic benzene moiety
  • carbonyl group
  • aromatic heteromonocyclic compound
  • monosaccharide
  • carboxylic acid derivative
  • saccharide
  • organic oxide
  • acetal
  • organonitrogen compound
  • organopnictogen compound
  • oxane
  • organoheterocyclic compound
  • acetamide
  • alcohol
  • carboxamide group
  • oxacycle
  • secondary carboxylic acid amide
  • fatty acid ester
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • secondary alcohol
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • organooxygen compound