Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 05:11:47 UTC
Update Date2025-03-24 14:13:27 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00798362
Frequency1.9
Structure
Chemical FormulaC5H10OS
Molecular Mass118.0452
SMILESC=CC[SH](C)C=O
InChI KeyHHERBFKEPWUCLN-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classthiolactones
Subclass thiolactones
Direct Parent thiolactones
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alkylthiols
  • allyl sulfur compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • organic oxides
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • organic oxide
  • organic oxygen compound
  • allyl sulfur compound
  • hydrocarbon derivative
  • organosulfur compound
  • carboxylic acid derivative
  • thiolactone
  • alkylthiol
  • organooxygen compound