Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:39:31 UTC
Update Date2025-03-25 00:46:20 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02154726
Frequency0.5
Structure
Chemical FormulaC17H20O6
Molecular Mass320.126
SMILESCOc1cc2cccc(C3OC(CO)C(O)C3O)c2cc1OC
InChI KeyFDJBAOFUTNNBSJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classnaphthalenes
Subclass naphthalenes
Direct Parent naphthalenes
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • alkyl aryl ethers
  • anisoles
  • dialkyl ethers
  • hydrocarbon derivatives
  • monosaccharides
  • oxacyclic compounds
  • primary alcohols
  • secondary alcohols
  • tetrahydrofurans
  • Substituents
  • alcohol
  • phenol ether
  • ether
  • tetrahydrofuran
  • monosaccharide
  • alkyl aryl ether
  • dialkyl ether
  • oxacycle
  • saccharide
  • naphthalene
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • anisole
  • secondary alcohol
  • hydrocarbon derivative
  • primary alcohol
  • organoheterocyclic compound
  • organooxygen compound