Hmdb loader

Showing information for DMID01776479

Record Information
HMDB StatusNot Available
Creation Date2024-02-21 11:59:34 UTC
Update Date2025-03-24 21:26:01 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01776479
Frequency0.7
Structure
Chemical FormulaC32H56O27
Molecular Mass872.3009
SMILESOCC1OC(OC2C(CO)OC(O)C(O)C2O)OC(CO)C1OC1C(O)C(O)C(O)C(COC2CC(O)OC(OC3C(CO)OC(O)C(O)C3O)C(O)C2O)C(O)C1O
InChI KeyXFPYQGOVADTQAQ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classoxepanes
Subclass oxepanes
Direct Parent oxepanes
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • 1,3-dioxanes
  • acetals
  • carboxylic acid orthoesters
  • cyclic alcohols and derivatives
  • dialkyl ethers
  • hemiacetals
  • hydrocarbon derivatives
  • monosaccharides
  • ortho esters
  • oxacyclic compounds
  • oxanes
  • primary alcohols
  • secondary alcohols
    • Substituents
  • alcohol
  • ether
  • ortho ester
  • monosaccharide
  • carboxylic acid orthoester
  • cyclic alcohol
  • dialkyl ether
  • oxepane
  • oxacycle
  • saccharide
  • organic oxygen compound
  • acetal
  • aliphatic heteromonocyclic compound
  • secondary alcohol
  • hemiacetal
  • hydrocarbon derivative
  • orthocarboxylic acid derivative
  • oxane
  • primary alcohol
  • meta-dioxane
  • organooxygen compound