Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:18:52 UTC
Update Date2025-03-21 18:35:51 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00107609
Frequency25.0
Structure
Chemical FormulaC6H8O2S
Molecular Mass144.0245
SMILESCC(=O)C1CCSC1=O
InChI KeyJUUAOSMFMZFXCH-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent 1,3-dicarbonyl compounds
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • carbothioic s-lactones
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • ketones
  • organic oxides
  • thioesters
  • thiolactones
  • thiolanes
  • Substituents
  • thiolane
  • carbothioic s-lactone
  • thiocarboxylic acid or derivatives
  • thiocarboxylic acid ester
  • carboxylic acid derivative
  • ketone
  • organic oxide
  • aliphatic heteromonocyclic compound
  • hydrocarbon derivative
  • 1,3-dicarbonyl compound
  • thiolactone
  • organoheterocyclic compound