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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:29:48 UTC
Update Date2025-03-21 18:41:18 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00133612
Frequency18.9
Structure
Chemical FormulaC22H40O14
Molecular Mass528.2418
SMILESOCCCCCC=CC(O)C(O)COC1C(O)C(O)C(OC2OC(CO)C(O)C(O)C2O)C(O)C1O
InChI KeyPUSMPUQIQVMLJT-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classfatty acyls
Subclass fatty acyl glycosides
Direct Parent fatty acyl glycosides of mono- and disaccharides
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • acetals
  • alkyl glycosides
  • cyclitols and derivatives
  • cyclohexanols
  • dialkyl ethers
  • fatty alcohols
  • hydrocarbon derivatives
  • monosaccharides
  • oxacyclic compounds
  • oxanes
  • primary alcohols
    • Substituents
  • alcohol
  • fatty acyl glycoside of mono- or disaccharide
  • ether
  • cyclohexanol
  • monosaccharide
  • cyclitol or derivatives
  • cyclic alcohol
  • dialkyl ether
  • oxacycle
  • saccharide
  • organic oxygen compound
  • acetal
  • fatty alcohol
  • aliphatic heteromonocyclic compound
  • secondary alcohol
  • hydrocarbon derivative
  • oxane
  • primary alcohol
  • organoheterocyclic compound
  • organooxygen compound
  • alkyl glycoside