Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:36:12 UTC
Update Date2025-03-21 17:57:14 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00006595
Frequency780.7
Structure
Chemical FormulaC16H22O7
Molecular Mass326.1366
SMILESCC=Cc1ccc(OC2OC(CO)C(O)C(O)C2O)c(OC)c1
InChI KeyKEOQVSSHVYLFJO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenol ethers
Subclass anisoles
Direct Parent anisoles
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • acetals
  • alkyl aryl ethers
  • hydrocarbon derivatives
  • methoxybenzenes
  • monosaccharides
  • oxacyclic compounds
  • oxanes
  • phenoxy compounds
  • primary alcohols
  • secondary alcohols
  • Substituents
  • alcohol
  • monocyclic benzene moiety
  • ether
  • aromatic heteromonocyclic compound
  • monosaccharide
  • alkyl aryl ether
  • methoxybenzene
  • oxacycle
  • saccharide
  • organic oxygen compound
  • acetal
  • anisole
  • secondary alcohol
  • hydrocarbon derivative
  • phenoxy compound
  • oxane
  • primary alcohol
  • organoheterocyclic compound
  • organooxygen compound