Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 06:21:41 UTC
Update Date2025-03-24 16:48:12 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00966627
Frequency1.5
Structure
Chemical FormulaC7H12OS
Molecular Mass144.0609
SMILESCSCC1C=CC(O)C1
InChI KeyLKWOZEOTXUEBLI-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent secondary alcohols
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • dialkylthioethers
  • hydrocarbon derivatives
  • sulfenyl compounds
  • Substituents
  • sulfenyl compound
  • thioether
  • dialkylthioether
  • secondary alcohol
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative
  • organosulfur compound