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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:22:48 UTC
Update Date2025-03-21 18:37:46 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00117136
Frequency22.4
Structure
Chemical FormulaC19H22O4
Molecular Mass314.1518
SMILESCC(C)Cc1ccc(C(C)C(=O)c2c(O)cc(O)cc2O)cc1
InChI KeyZUVKDUPISPZOQU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslignans, neolignans and related compounds
ClassNot Available
Subclass lignans, neolignans and related compounds
Direct Parent lignans, neolignans and related compounds
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • acylphloroglucinols and derivatives
  • alkyl-phenylketones
  • alpha-methyldeoxybenzoin flavonoids
  • aromatic monoterpenoids
  • aryl alkyl ketones
  • benzoyl derivatives
  • hydrocarbon derivatives
  • monocyclic monoterpenoids
  • organic oxides
  • organooxygen compounds
  • phenylpropanes
  • stilbenes
  • vinylogous acids
    • Substituents
  • monoterpenoid
  • monocyclic benzene moiety
  • monocyclic monoterpenoid
  • aryl alkyl ketone
  • benzoyl
  • 1-hydroxy-2-unsubstituted benzenoid
  • p-cymene
  • neolignan skeleton
  • ketone
  • phenylpropane
  • phloroglucinol derivative
  • organic oxide
  • acylphloroglucinol derivative
  • benzenetriol
  • 1-hydroxy-4-unsubstituted benzenoid
  • phenylketone
  • alpha-methyldeoxybenzoin flavonoid
  • aromatic homomonocyclic compound
  • vinylogous acid
  • organic oxygen compound
  • phenol
  • hydrocarbon derivative
  • benzenoid
  • alkyl-phenylketone
  • organooxygen compound
  • aromatic monoterpenoid
  • aryl ketone
  • stilbene