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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:09:12 UTC
Update Date2025-03-21 18:31:06 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00084240
Frequency34.1
Structure
Chemical FormulaC20H36O17
Molecular Mass548.1952
SMILESOCC1OC(OCC2C(CO)OC(OC3C(CO)OC(O)C(O)C3O)C(O)C(O)C2O)C(O)C(O)C1O
InChI KeyVRPHPGQBBICXRK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classoxepanes
Subclass oxepanes
Direct Parent oxepanes
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • acetals
  • hemiacetals
  • hydrocarbon derivatives
  • monosaccharides
  • oxacyclic compounds
  • oxanes
  • primary alcohols
  • secondary alcohols
    • Substituents
  • alcohol
  • monosaccharide
  • oxepane
  • oxacycle
  • saccharide
  • organic oxygen compound
  • acetal
  • aliphatic heteromonocyclic compound
  • secondary alcohol
  • hemiacetal
  • hydrocarbon derivative
  • oxane
  • primary alcohol
  • organooxygen compound