Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:40:31 UTC
Update Date2025-03-25 00:46:44 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02156963
Frequency0.5
Structure
Chemical FormulaC13H9ClO5
Molecular Mass280.0139
SMILESO=C(c1ccc(Cl)cc1O)c1c(O)cc(O)cc1O
InChI KeyTXWHWFAUZMKEHY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass benzophenones
Direct Parent benzophenones
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • aryl chlorides
  • aryl ketones
  • aryl-phenylketones
  • benzoyl derivatives
  • chlorobenzenes
  • diphenylmethanes
  • halophenols
  • hydrocarbon derivatives
  • m-chlorophenols
  • organic oxides
  • organochlorides
  • organooxygen compounds
  • phloroglucinols and derivatives
  • vinylogous acids
  • Substituents
  • diphenylmethane
  • organochloride
  • benzoyl
  • 1-hydroxy-2-unsubstituted benzenoid
  • organohalogen compound
  • benzophenone
  • ketone
  • phloroglucinol derivative
  • organic oxide
  • aryl chloride
  • chlorobenzene
  • 3-halophenol
  • 3-chlorophenol
  • benzenetriol
  • aryl-phenylketone
  • 1-hydroxy-4-unsubstituted benzenoid
  • aryl halide
  • aromatic homomonocyclic compound
  • vinylogous acid
  • organic oxygen compound
  • phenol
  • hydrocarbon derivative
  • halobenzene
  • organooxygen compound
  • aryl ketone