Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 02:35:52 UTC
Update Date2025-03-21 21:52:56 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00428404
Frequency4.2
Structure
Chemical FormulaC4H8O2S
Molecular Mass120.0245
SMILESO=CCC(O)CS
InChI KeyPPJMJYFSGBVCJR-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent beta-hydroxy aldehydes
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alkylthiols
  • alpha-hydrogen aldehydes
  • hydrocarbon derivatives
  • organic oxides
  • organosulfur compounds
  • secondary alcohols
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • beta-hydroxy aldehyde
  • organosulfur compound
  • organic oxide
  • alpha-hydrogen aldehyde
  • secondary alcohol
  • hydrocarbon derivative
  • alkylthiol