Hmdb loader

Showing information for DMID02206730

Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:02:24 UTC
Update Date2025-03-25 00:54:30 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02206730
Frequency0.5
Structure
Chemical FormulaC8H6Cl2O2
Molecular Mass203.9745
SMILESO=C(CCl)c1ccc(O)c(Cl)c1
InChI KeyYCAQBCPDPOPUMU-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
  • alkyl chlorides
  • alpha-chloroketones
  • aryl alkyl ketones
  • aryl chlorides
  • benzoyl derivatives
  • chlorobenzenes
  • halophenols
  • hydrocarbon derivatives
  • o-chlorophenols
  • organic oxides
  • organochlorides
  • organooxygen compounds
    • Substituents
  • monocyclic benzene moiety
  • aryl alkyl ketone
  • alkyl chloride
  • organochloride
  • benzoyl
  • 1-hydroxy-2-unsubstituted benzenoid
  • organohalogen compound
  • organic oxide
  • alpha-haloketone
  • alkyl halide
  • aryl chloride
  • 2-chlorophenol
  • chlorobenzene
  • aryl halide
  • alpha-chloroketone
  • aromatic homomonocyclic compound
  • 2-halophenol
  • phenol
  • hydrocarbon derivative
  • benzenoid
  • halobenzene
  • alkyl-phenylketone