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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:15:31 UTC
Update Date2025-03-25 00:59:23 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02236743
Frequency0.5
Structure
Chemical FormulaC11H14O4
Molecular Mass210.0892
SMILESOc1ccc(C(O)C2OCCC2O)cc1
InChI KeyOHOQCCBQZLUYIC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenols
Subclass 1-hydroxy-2-unsubstituted benzenoids
Direct Parent 1-hydroxy-2-unsubstituted benzenoids
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • aromatic alcohols
  • benzene and substituted derivatives
  • dialkyl ethers
  • hydrocarbon derivatives
  • monosaccharides
  • oxacyclic compounds
  • secondary alcohols
  • tetrahydrofurans
    • Substituents
  • aromatic alcohol
  • alcohol
  • monocyclic benzene moiety
  • ether
  • aromatic heteromonocyclic compound
  • tetrahydrofuran
  • 1-hydroxy-2-unsubstituted benzenoid
  • monosaccharide
  • dialkyl ether
  • oxacycle
  • saccharide
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • organoheterocyclic compound
  • organooxygen compound