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Record Information
HMDB Statusexpected
Creation Date2024-02-20 23:37:19 UTC
Update Date2025-03-21 17:57:38 UTC
HMDB IDHMDB0304461
Metabolite Identification
DeepMet IDDMID00009221
Namephlorisobutyrophenone
Frequency525.2
Structure
Chemical FormulaC10H12O4
Molecular Mass196.0736
SMILESCC(C)C(=O)c1c(O)cc(O)cc1O
InChI KeyBNEBXEZRBLYBCZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent alkyl-phenylketones
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • acylphloroglucinols and derivatives
  • aryl alkyl ketones
  • benzoyl derivatives
  • hydrocarbon derivatives
  • organic oxides
  • organooxygen compounds
  • phenylpropanes
  • vinylogous acids
  • Substituents
  • acylphloroglucinol derivative
  • monocyclic benzene moiety
  • aryl alkyl ketone
  • benzenetriol
  • benzoyl
  • 1-hydroxy-2-unsubstituted benzenoid
  • 1-hydroxy-4-unsubstituted benzenoid
  • phenylpropane
  • phloroglucinol derivative
  • aromatic homomonocyclic compound
  • vinylogous acid
  • organic oxide
  • phenol
  • hydrocarbon derivative
  • benzenoid
  • alkyl-phenylketone