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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:01:24 UTC
Update Date2025-03-25 00:54:09 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02204479
Frequency0.5
Structure
Chemical FormulaC17H30O15
Molecular Mass474.1585
SMILESO=CC(OC1C(O)C(OC2C(CO)OC(O)C(O)C2O)OC(CO)C(O)C1O)C(O)CO
InChI KeyNKSUXSRMRFXAIG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classoxepanes
Subclass oxepanes
Direct Parent oxepanes
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • acetals
  • beta-hydroxy aldehydes
  • dialkyl ethers
  • hemiacetals
  • hydrocarbon derivatives
  • monosaccharides
  • organic oxides
  • oxacyclic compounds
  • oxanes
  • primary alcohols
  • secondary alcohols
    • Substituents
  • alcohol
  • beta-hydroxy aldehyde
  • carbonyl group
  • ether
  • monosaccharide
  • aldehyde
  • dialkyl ether
  • oxepane
  • oxacycle
  • saccharide
  • organic oxide
  • organic oxygen compound
  • acetal
  • aliphatic heteromonocyclic compound
  • secondary alcohol
  • hemiacetal
  • hydrocarbon derivative
  • oxane
  • primary alcohol
  • organooxygen compound