Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:23:05 UTC
Update Date2025-03-25 01:02:09 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02254086
Frequency0.5
Structure
Chemical FormulaC10H12OS
Molecular Mass180.0609
SMILESC=CCc1ccc(O)c(SC)c1
InChI KeyRVJJCRVBNCILIB-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
  • alkylarylthioethers
  • benzene and substituted derivatives
  • hydrocarbon derivatives
  • organooxygen compounds
  • sulfenyl compounds
  • thiophenol ethers
  • Substituents
  • monocyclic benzene moiety
  • sulfenyl compound
  • 1-hydroxy-2-unsubstituted benzenoid
  • alkylarylthioether
  • organosulfur compound
  • aryl thioether
  • aromatic homomonocyclic compound
  • thiophenol
  • organic oxygen compound
  • thioether
  • thiophenol ether
  • phenol
  • hydrocarbon derivative
  • organooxygen compound