Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:21:48 UTC
Update Date2025-03-25 01:01:43 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02251260
Frequency0.5
Structure
Chemical FormulaC13H18O7
Molecular Mass286.1053
SMILESOC(O)C1C(O)C(O)C(O)C(Oc2ccccc2)C1O
InChI KeyMALJEENEXHGIGT-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenol ethers
Subclass phenol ethers
Direct Parent phenol ethers
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • alkyl aryl ethers
  • carbonyl hydrates
  • cyclitols and derivatives
  • cyclohexanols
  • hydrocarbon derivatives
  • phenoxy compounds
  • Substituents
  • alcohol
  • phenol ether
  • monocyclic benzene moiety
  • ether
  • carbonyl hydrate
  • cyclohexanol
  • cyclitol or derivatives
  • cyclic alcohol
  • alkyl aryl ether
  • aromatic homomonocyclic compound
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • phenoxy compound
  • organooxygen compound