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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 IDDMID02170102
Frequency0.5
Structure
Chemical FormulaC26H48O13
Molecular Mass568.3095
SMILESCCCCCCCCCCCC(O)CC(=O)OCC1OC(OC2(CO)OC(CO)C(O)C2O)C(O)C(O)C1O
InChI KeyWGSRSSLKMFZJLM-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classsaccharolipids
Subclass saccharolipids
Direct Parent saccharolipids
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • alkyl glycosides
  • beta hydroxy acids and derivatives
  • carbonyl compounds
  • carboxylic acid esters
  • fatty acid esters
  • fatty acyl glycosides of mono- and disaccharides
  • fatty alcohols
  • hydrocarbon derivatives
  • ketals
  • monocarboxylic acids and derivatives
  • monosaccharides
  • organic oxides
  • oxacyclic compounds
  • oxanes
  • primary alcohols
  • secondary alcohols
  • tetrahydrofurans
  • Substituents
  • fatty acyl
  • fatty acyl glycoside of mono- or disaccharide
  • carbonyl group
  • monosaccharide
  • carboxylic acid derivative
  • beta-hydroxy acid
  • saccharide
  • organic oxide
  • acetal
  • fatty alcohol
  • ketal
  • aliphatic heteromonocyclic compound
  • oxane
  • primary alcohol
  • organoheterocyclic compound
  • alcohol
  • fatty acyl glycoside
  • tetrahydrofuran
  • hydroxy acid
  • oxacycle
  • fatty acid ester
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • secondary alcohol
  • hydrocarbon derivative
  • saccharolipid
  • organooxygen compound
  • alkyl glycoside