Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:11:21 UTC
Update Date2025-03-25 00:57:53 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02227373
Frequency0.5
Structure
Chemical FormulaC10H12O2S
Molecular Mass196.0558
SMILESC=CCc1ccc(O)c(S(C)=O)c1
InChI KeyFOMPMVYCEIYJSG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass phenyl sulfoxides
Direct Parent phenyl sulfoxides
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • hydrocarbon derivatives
  • organic oxides
  • organooxygen compounds
  • sulfinyl compounds
  • sulfoxides
  • Substituents
  • 1-hydroxy-2-unsubstituted benzenoid
  • organosulfur compound
  • aromatic homomonocyclic compound
  • organic oxide
  • phenyl sulfoxide
  • organic oxygen compound
  • sulfinyl compound
  • sulfoxide
  • phenol
  • hydrocarbon derivative
  • organooxygen compound