Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 11:48:09 UTC
Update Date2025-03-24 21:21:03 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01749798
Frequency0.7
Structure
Chemical FormulaC4H8OS
Molecular Mass104.0296
SMILESC[SH]=CCC=O
InChI KeyVCZRKEJDGBHVSO-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
  • thioaldehydes
  • Substituents
  • aliphatic acyclic compound
  • organic oxide
  • thioaldehyde
  • alpha-hydrogen aldehyde
  • hydrocarbon derivative
  • organosulfur compound
  • alkylthiol