Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 11:29:15 UTC
Update Date2025-03-24 21:12:15 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01704331
Frequency0.7
Structure
Chemical FormulaC7H12OS
Molecular Mass144.0609
SMILESCC(=O)CCSC1CC1
InChI KeySJUYKLYUPQBJCU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent ketones
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • dialkylthioethers
  • hydrocarbon derivatives
  • organic oxides
  • sulfenyl compounds
  • Substituents
  • ketone
  • organic oxide
  • sulfenyl compound
  • thioether
  • dialkylthioether
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative
  • organosulfur compound