Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 08:35:03 UTC
Update Date2025-03-25 00:20:39 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01287899
Frequency1.0
Structure
Chemical FormulaC5H8O2S
Molecular Mass132.0245
SMILESCCC(=O)SC(C)=O
InChI KeyHQABSVBFDCADQK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classthiolactones
Subclass thiolactones
Direct Parent thiolactones
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • organic oxides
  • sulfenyl compounds
  • thiocarboxylic acids and derivatives
  • Substituents
  • aliphatic acyclic compound
  • thiocarboxylic acid or derivatives
  • carbonyl group
  • organic oxide
  • organic oxygen compound
  • sulfenyl compound
  • hydrocarbon derivative
  • organosulfur compound
  • carboxylic acid derivative
  • thiolactone
  • organooxygen compound