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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:18:44 UTC
Update Date2025-03-25 01:00:42 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02244161
Frequency0.5
Structure
Chemical FormulaC44H85NO7S
Molecular Mass771.6047
SMILESCCCCCCCCCCCCCC=CC(O)C(CSC1OC(CO)C(O)C(O)C1O)NC(=O)CCCCCCCCCCCCCCCCCCC
InChI KeyOSXRMUALRYPKLW-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classfatty acyls
Subclass fatty amides
Direct Parent n-acyl amines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • monosaccharides
  • monothioacetals
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • oxanes
  • primary alcohols
  • secondary alcohols
  • secondary carboxylic acid amides
  • sulfenyl compounds
  • Substituents
  • carbonyl group
  • monosaccharide
  • organosulfur compound
  • carboxylic acid derivative
  • monothioacetal
  • saccharide
  • organic oxide
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • oxane
  • primary alcohol
  • organoheterocyclic compound
  • alcohol
  • sulfenyl compound
  • carboxamide group
  • n-acyl-amine
  • oxacycle
  • secondary carboxylic acid amide
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound