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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 12:01:25 UTC
Update Date2025-03-24 21:26:43 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01780568
Frequency0.7
Structure
Chemical FormulaC37H64O31
Molecular Mass1004.3432
SMILESCC1OC(OC2C(CO)OC(OCC3OC(OC4C(CO)OC(O)C(O)C4O)C(O)C(OC4C(CO)OC(O)C(O)C4O)OC3CO)C(O)C2OC2OC(CO)C(O)C(O)C2O)C(O)C(O)C1O
InChI KeyCMKQHDUBELCMAA-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdioxepanes
Subclass 1,4-dioxepanes
Direct Parent 1,4-dioxepanes
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • acetals
  • hemiacetals
  • hydrocarbon derivatives
  • monosaccharides
  • oxacyclic compounds
  • oxanes
  • primary alcohols
  • secondary alcohols
    • Substituents
  • alcohol
  • 1,4-dioxepane
  • monosaccharide
  • oxacycle
  • saccharide
  • organic oxygen compound
  • acetal
  • aliphatic heteromonocyclic compound
  • secondary alcohol
  • hemiacetal
  • hydrocarbon derivative
  • oxane
  • primary alcohol
  • organooxygen compound