Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 09:35:59 UTC
Update Date2025-03-24 20:23:28 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01433389
Frequency0.9
Structure
Chemical FormulaC7H12OS
Molecular Mass144.0609
SMILESCSCC1(O)C=CCC1
InChI KeyYBZNEPQENFFNCC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent tertiary alcohols
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • dialkylthioethers
  • hydrocarbon derivatives
  • sulfenyl compounds
  • Substituents
  • tertiary alcohol
  • sulfenyl compound
  • thioether
  • dialkylthioether
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative
  • organosulfur compound