Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:08:50 UTC
Update Date2025-03-25 00:35:23 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02083143
Frequency0.6
Structure
Chemical FormulaC5H12O2S
Molecular Mass136.0558
SMILESC[SH](C)(=O)CCC=O
InChI KeyKYYKZMDWICKHDG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent alpha-hydrogen aldehydes
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alkylthiols
  • hydrocarbon derivatives
  • organic oxides
  • organosulfur compounds
  • Substituents
  • aliphatic acyclic compound
  • organic oxide
  • alpha-hydrogen aldehyde
  • hydrocarbon derivative
  • organosulfur compound
  • alkylthiol