Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 07:42:47 UTC
Update Date2025-03-24 22:19:58 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01160860
Frequency1.2
Structure
Chemical FormulaC7H12OS
Molecular Mass144.0609
SMILESCSC1C=CCC(O)C1
InChI KeyNVBGBDPKOSCWHJ-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