Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:58:08 UTC
Update Date2025-03-21 18:05:35 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00057742
Frequency54.9
Structure
Chemical FormulaC9H12OS
Molecular Mass168.0609
SMILESCSCCc1ccc(O)cc1
InChI KeyBDHVMTYUGHSPKO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenols
Subclass 1-hydroxy-2-unsubstituted benzenoids
Direct Parent 1-hydroxy-2-unsubstituted benzenoids
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • benzene and substituted derivatives
  • dialkylthioethers
  • hydrocarbon derivatives
  • organooxygen compounds
  • sulfenyl compounds
  • Substituents
  • monocyclic benzene moiety
  • sulfenyl compound
  • dialkylthioether
  • 1-hydroxy-2-unsubstituted benzenoid
  • organosulfur compound
  • aromatic homomonocyclic compound
  • organic oxygen compound
  • thioether
  • hydrocarbon derivative
  • organooxygen compound