Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 07:01:40 UTC
Update Date2025-03-24 19:51:38 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01061490
Frequency1.3
Structure
Chemical FormulaC3H6O2S2
Molecular Mass137.9809
SMILESCSS(=O)C(C)=O
InChI KeyQWTTXAARRGLKQP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classthiosulfinic acid esters
Subclass thiosulfinic acid esters
Direct Parent thiosulfinic acid esters
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • organic oxides
  • sulfenyl compounds
  • sulfinyl compounds
  • thiolactones
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • sulfenyl compound
  • organosulfur compound
  • carboxylic acid derivative
  • organic oxide
  • thiosulfinic acid ester
  • organic oxygen compound
  • sulfinyl compound
  • hydrocarbon derivative
  • thiolactone
  • organooxygen compound