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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:31:18 UTC
Update Date2025-03-21 18:41:57 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00137022
Frequency18.3
Structure
Chemical FormulaC16H16O5
Molecular Mass288.0998
SMILESCc1c(O)c(O)cc(O)c1C(=O)C(C)c1ccc(O)cc1
InChI KeyWBHLUTFUOLNMED-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassphenylpropanoids and polyketides
Classalpha-methyldeoxybenzoin flavonoids
Subclass alpha-methyldeoxybenzoin flavonoids
Direct Parent alpha-methyldeoxybenzoin flavonoids
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • alkyl-phenylketones
  • aryl alkyl ketones
  • benzoyl derivatives
  • hydrocarbon derivatives
  • meta cresols
  • organic oxides
  • organooxygen compounds
  • ortho cresols
  • phenylpropanes
  • stilbenes
  • toluenes
  • vinylogous acids
    • Substituents
  • monocyclic benzene moiety
  • aryl alkyl ketone
  • m-cresol
  • benzoyl
  • 1-hydroxy-2-unsubstituted benzenoid
  • phenylketone
  • alpha-methyldeoxybenzoin flavonoid
  • ketone
  • phenylpropane
  • aromatic homomonocyclic compound
  • vinylogous acid
  • organic oxide
  • organic oxygen compound
  • o-cresol
  • phenol
  • hydrocarbon derivative
  • benzenoid
  • toluene
  • alkyl-phenylketone
  • organooxygen compound
  • aryl ketone
  • stilbene