Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 01:32:24 UTC
Update Date2025-03-21 19:21:45 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00279381
Frequency7.3
Structure
Chemical FormulaC6H6O2S
Molecular Mass142.0088
SMILESOc1cccc(S)c1O
InChI KeyCXMBJBCPGQIVET-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