Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:12:11 UTC
Update Date2025-03-21 18:32:31 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00091207
Frequency30.8
Structure
Chemical FormulaC9H12S
Molecular Mass152.066
SMILESCSC(C)c1ccccc1
InChI KeyVRWTYTHRWWKAGO-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
  • dialkylthioethers
  • hydrocarbon derivatives
  • sulfenyl compounds
  • Substituents
  • aromatic homomonocyclic compound
  • monocyclic benzene moiety
  • sulfenyl compound
  • thioether
  • dialkylthioether
  • hydrocarbon derivative
  • organosulfur compound