Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 02:53:11 UTC
Update Date2025-03-21 22:00:44 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00469136
Frequency3.7
Structure
Chemical FormulaC6H6OS
Molecular Mass126.0139
SMILESOc1cccc(S)c1
InChI KeyDOFIAZGYBIBEGI-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classthiophenols
Subclass thiophenols
Direct Parent thiophenols
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • benzene and substituted derivatives
  • hydrocarbon derivatives
  • organooxygen compounds
  • thiols
  • Substituents
  • monocyclic benzene moiety
  • 1-hydroxy-2-unsubstituted benzenoid
  • arylthiol
  • 1-hydroxy-4-unsubstituted benzenoid
  • organosulfur compound
  • aromatic homomonocyclic compound
  • thiophenol
  • organic oxygen compound
  • phenol
  • hydrocarbon derivative
  • organooxygen compound