Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 03:34:47 UTC
Update Date2025-03-21 22:50:55 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00567895
Frequency2.9
Structure
Chemical FormulaC6H8O2S
Molecular Mass144.0245
SMILESCC(=O)C1SCCC1=O
InChI KeyYLJGMDJCFQJRFM-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent beta-diketones
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • cyclic ketones
  • dialkylthioethers
  • hydrocarbon derivatives
  • organic oxides
  • thiolanes
  • Substituents
  • thiolane
  • dialkylthioether
  • cyclic ketone
  • ketone
  • organic oxide
  • thioether
  • aliphatic heteromonocyclic compound
  • hydrocarbon derivative
  • organoheterocyclic compound
  • 1,3-diketone