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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:07:22 UTC
Update Date2025-03-25 00:56:26 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02218359
Frequency0.5
Structure
Chemical FormulaC11H16O2
Molecular Mass180.115
SMILESCc1cccc(C)c1OCC(C)O
InChI KeyQFOWJPBDGSGFEJ-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
  • hydrocarbon derivatives
  • phenoxy compounds
  • secondary alcohols
  • m-xylenes
    • Substituents
  • alcohol
  • phenol ether
  • monocyclic benzene moiety
  • ether
  • m-xylene
  • alkyl aryl ether
  • aromatic homomonocyclic compound
  • xylene
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • phenoxy compound
  • organooxygen compound