Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:37:37 UTC
Update Date2025-03-25 00:45:37 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02150254
Frequency0.5
Structure
Chemical FormulaC22H28O11
Molecular Mass468.1632
SMILESOCC1OC(OC2C(CO)OC(Oc3ccc4ccccc4c3)C(O)C2O)C(O)C(O)C1O
InChI KeyCWRXWBYMRKYJEP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classnaphthalenes
Subclass naphthalenes
Direct Parent naphthalenes
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • acetals
  • hydrocarbon derivatives
  • monosaccharides
  • oxacyclic compounds
  • oxanes
  • phenol ethers
  • primary alcohols
  • secondary alcohols
  • Substituents
  • alcohol
  • phenol ether
  • monosaccharide
  • oxacycle
  • saccharide
  • naphthalene
  • organic oxygen compound
  • acetal
  • aromatic heteropolycyclic compound
  • secondary alcohol
  • hydrocarbon derivative
  • oxane
  • primary alcohol
  • organoheterocyclic compound
  • organooxygen compound