Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:00:28 UTC
Update Date2025-03-25 00:53:50 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02202328
Frequency0.5
Structure
Chemical FormulaC14H16OS
Molecular Mass232.0922
SMILESC[SH](C)(=O)c1ccc(-c2ccccc2)cc1
InChI KeyKWVDORJHPLBEGO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass benzene and substituted derivatives
Direct Parent benzene and substituted derivatives
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • alkylthiols
  • hydrocarbon derivatives
  • organic oxides
  • organosulfur compounds
  • Substituents
  • aromatic homomonocyclic compound
  • monocyclic benzene moiety
  • organic oxide
  • organic oxygen compound
  • hydrocarbon derivative
  • organosulfur compound
  • alkylthiol