Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:52:30 UTC
Update Date2025-03-21 18:03:29 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00044574
Frequency75.8
Structure
Chemical FormulaC13H18O6
Molecular Mass270.1103
SMILESOC1C(O)C(O)C(OCc2ccccc2)C(O)C1O
InChI KeyRWDNROPIZFGEAU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass benzylethers
Direct Parent benzylethers
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • cyclitols and derivatives
  • cyclohexanols
  • dialkyl ethers
  • hydrocarbon derivatives
  • Substituents
  • alcohol
  • ether
  • benzylether
  • cyclohexanol
  • cyclitol or derivatives
  • cyclic alcohol
  • dialkyl ether
  • aromatic homomonocyclic compound
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • organooxygen compound