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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:39:42 UTC
Update Date2025-03-25 00:46:25 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02155159
Frequency0.5
Structure
Chemical FormulaC16H14O2
Molecular Mass238.0994
SMILESCc1cc(C(=O)C=Cc2ccccc2)ccc1O
InChI KeySHPMQNTYESNIQW-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassphenylpropanoids and polyketides
Classlinear 1,3-diarylpropanoids
Subclass cinnamylphenols
Direct Parent cinnamylphenols
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • alpha,beta-unsaturated ketones
  • aryl ketones
  • benzoyl derivatives
  • cinnamic acids and derivatives
  • hydrocarbon derivatives
  • organic oxides
  • organooxygen compounds
  • ortho cresols
  • toluenes
    • Substituents
  • monocyclic benzene moiety
  • benzoyl
  • 1-hydroxy-2-unsubstituted benzenoid
  • cinnamylphenol
  • alpha,beta-unsaturated ketone
  • ketone
  • aromatic homomonocyclic compound
  • cinnamic acid or derivatives
  • organic oxide
  • organic oxygen compound
  • o-cresol
  • phenol
  • hydrocarbon derivative
  • benzenoid
  • toluene
  • organooxygen compound
  • aryl ketone