Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:46:08 UTC
Update Date2025-03-25 00:48:41 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02169584
Frequency0.5
Structure
Chemical FormulaC9H14OS
Molecular Mass170.0765
SMILESCCSCCc1ccc(C)o1
InChI KeyKBJSHZHUEKSPKW-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classfurans
Subclass furans
Direct Parent furans
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • dialkylthioethers
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organooxygen compounds
  • oxacyclic compounds
  • sulfenyl compounds
  • Substituents
  • furan
  • sulfenyl compound
  • aromatic heteromonocyclic compound
  • dialkylthioether
  • heteroaromatic compound
  • organosulfur compound
  • oxacycle
  • organic oxygen compound
  • thioether
  • hydrocarbon derivative
  • organooxygen compound