Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 08:11:45 UTC
Update Date2025-03-24 22:35:25 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01232139
Frequency1.1
Structure
Chemical FormulaC4H6O2S
Molecular Mass118.0088
SMILESC=CCS(=O)C=O
InChI KeyFUOPXJNHBYFFRY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classthiolactones
Subclass thiolactones
Direct Parent thiolactones
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • allyl sulfur compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • organic oxides
  • sulfinyl compounds
  • sulfoxides
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • allyl sulfur compound
  • organosulfur compound
  • carboxylic acid derivative
  • organic oxide
  • organic oxygen compound
  • sulfinyl compound
  • sulfoxide
  • hydrocarbon derivative
  • thiolactone
  • organooxygen compound