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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:18:22 UTC
Update Date2025-03-21 18:35:35 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00106350
Frequency25.3
Structure
Chemical FormulaC18H32O16
Molecular Mass504.169
SMILESOCC1OC(CO)(OC2OC(CO)C(OC3C(CO)OC(O)C(O)C3O)C(O)C2O)C(O)C1O
InChI KeyPKIIZGURZLRTAD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass ethers
Direct Parent ketals
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • dialkyl ethers
  • hemiacetals
  • hydrocarbon derivatives
  • monosaccharides
  • oxacyclic compounds
  • oxanes
  • primary alcohols
  • secondary alcohols
  • tetrahydrofurans
    • Substituents
  • alcohol
  • tetrahydrofuran
  • monosaccharide
  • dialkyl ether
  • oxacycle
  • saccharide
  • ketal
  • aliphatic heteromonocyclic compound
  • secondary alcohol
  • hemiacetal
  • hydrocarbon derivative
  • oxane
  • primary alcohol
  • organoheterocyclic compound