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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:49:39 UTC
Update Date2025-03-25 00:49:57 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02177756
Frequency0.5
Structure
Chemical FormulaC16H18O3
Molecular Mass258.1256
SMILESCc1ccc(C(O)C(C)c2ccc(O)cc2)c(O)c1
InChI KeyPGALJJIWQJSCSD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassphenylpropanoids and polyketides
Class1,2-diaryl-2-propen-1-ols
Subclass 1,2-diaryl-2-propen-1-ols
Direct Parent 1,2-diaryl-2-propen-1-ols
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • aromatic alcohols
  • hydrocarbon derivatives
  • meta cresols
  • phenylpropanes
  • secondary alcohols
  • stilbenes
  • toluenes
    • Substituents
  • aromatic alcohol
  • alcohol
  • monocyclic benzene moiety
  • m-cresol
  • 1-hydroxy-2-unsubstituted benzenoid
  • 1,2-diaryl-2-propen-1-ol
  • 1-hydroxy-4-unsubstituted benzenoid
  • phenylpropane
  • aromatic homomonocyclic compound
  • organic oxygen compound
  • secondary alcohol
  • phenol
  • hydrocarbon derivative
  • benzenoid
  • toluene
  • organooxygen compound
  • stilbene