Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:39:58 UTC
Update Date2025-03-25 00:46:32 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02155748
Frequency0.5
Structure
Chemical FormulaC6H8O2S
Molecular Mass144.0245
SMILESCSc1cc(CO)co1
InChI KeyCSSDTOCSZPWJGB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganosulfur compounds
Classthioethers
Subclass aryl thioethers
Direct Parent aryl thioethers
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • alkylarylthioethers
  • aromatic alcohols
  • furans
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • oxacyclic compounds
  • sulfenyl compounds
  • Substituents
  • aromatic alcohol
  • alcohol
  • furan
  • sulfenyl compound
  • aromatic heteromonocyclic compound
  • heteroaromatic compound
  • alkylarylthioether
  • aryl thioether
  • oxacycle
  • organic oxygen compound
  • hydrocarbon derivative
  • organoheterocyclic compound
  • organooxygen compound