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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:53:25 UTC
Update Date2025-03-25 00:51:20 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02186289
Frequency0.5
Structure
Chemical FormulaC14H27NO12
Molecular Mass401.1533
SMILESNCC1(OCOC2OC(CO)C(O)C(O)C2O)OC(CO)C(O)C(O)C1O
InChI KeyCOUFITHMNVOCTM-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass ethers
Direct Parent ketals
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • monoalkylamines
  • monosaccharides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • oxanes
  • primary alcohols
  • secondary alcohols
  • Substituents
  • alcohol
  • monosaccharide
  • oxacycle
  • saccharide
  • ketal
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • oxane
  • primary alcohol
  • organoheterocyclic compound