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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:19:15 UTC
Update Date2025-03-21 18:36:02 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00108525
Frequency24.7
Structure
Chemical FormulaC18H32O16
Molecular Mass504.169
SMILESOCC1OC(OC2C(CO)OC(O)C(O)C2O)C(CO)OC1OC1OC(CO)C(O)C(O)C1O
InChI KeyMAJQYSCBEZGXTD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdioxanes
Subclass 1,4-dioxanes
Direct Parent 1,4-dioxanes
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • acetals
  • hemiacetals
  • hydrocarbon derivatives
  • monosaccharides
  • oxacyclic compounds
  • oxanes
  • primary alcohols
  • secondary alcohols
    • Substituents
  • alcohol
  • monosaccharide
  • oxacycle
  • saccharide
  • organic oxygen compound
  • acetal
  • para-dioxane
  • aliphatic heteromonocyclic compound
  • secondary alcohol
  • hemiacetal
  • hydrocarbon derivative
  • oxane
  • primary alcohol
  • organooxygen compound