Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:49:55 UTC
Update Date2025-03-25 00:50:02 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02178358
Frequency0.5
Structure
Chemical FormulaC12H7ClS
Molecular Mass217.9957
SMILESClc1ccc2c(c1)sc1ccccc12
InChI KeyOTHHPAMDVKDMFM-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classbenzothiophenes
Subclass dibenzothiophenes
Direct Parent dibenzothiophenes
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-benzothiophenes
  • aryl chlorides
  • benzenoids
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organochlorides
  • thiophenes
  • Substituents
  • aryl chloride
  • dibenzothiophene
  • organochloride
  • heteroaromatic compound
  • thiophene
  • organohalogen compound
  • aryl halide
  • aromatic heteropolycyclic compound
  • 1-benzothiophene
  • hydrocarbon derivative
  • benzenoid