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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:41:42 UTC
Update Date2025-03-25 00:47:06 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02159531
Frequency0.5
Structure
Chemical FormulaC11H9ClO
Molecular Mass192.0342
SMILESC=C1C(=O)CCc2cc(Cl)ccc21
InChI KeyWKLZOTVFCOFCNT-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classtetralins
Subclass tetralins
Direct Parent tetralins
Geometric Descriptor aromatic homopolycyclic compounds
Alternative Parents
  • aryl chlorides
  • cyclic ketones
  • hydrocarbon derivatives
  • organic oxides
  • organochlorides
    • Substituents
  • aryl chloride
  • tetralin
  • carbonyl group
  • organochloride
  • aromatic homopolycyclic compound
  • cyclic ketone
  • organohalogen compound
  • aryl halide
  • ketone
  • organic oxide
  • organic oxygen compound
  • hydrocarbon derivative
  • organooxygen compound