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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:15:10 UTC
Update Date2025-03-25 00:59:14 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02235973
Frequency0.5
Structure
Chemical FormulaC18H26O8
Molecular Mass370.1628
SMILESOCC1OC(Oc2cc(C3CCCCC3O)ccc2O)C(O)C(O)C1O
InChI KeyQBGBKMULJHXFOD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass cyclohexylphenols
Direct Parent cyclohexylphenols
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • acetals
  • cyclic alcohols and derivatives
  • cyclohexanols
  • hydrocarbon derivatives
  • monosaccharides
  • oxacyclic compounds
  • oxanes
  • phenol ethers
  • phenoxy compounds
  • primary alcohols
  • Substituents
  • alcohol
  • cyclohexylphenol
  • phenol ether
  • aromatic heteromonocyclic compound
  • cyclohexanol
  • 1-hydroxy-2-unsubstituted benzenoid
  • monosaccharide
  • cyclic alcohol
  • oxacycle
  • saccharide
  • organic oxygen compound
  • acetal
  • secondary alcohol
  • phenol
  • hydrocarbon derivative
  • phenoxy compound
  • oxane
  • primary alcohol
  • organoheterocyclic compound
  • organooxygen compound