Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:44:07 UTC
Update Date2025-03-21 18:00:00 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00024579
Frequency158.3
Structure
Chemical FormulaC4H8O2S
Molecular Mass120.0245
SMILESCS(=O)CCC=O
InChI KeyPAKZONRVPRLZKM-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
  • hydrocarbon derivatives
  • organic oxides
  • sulfinyl compounds
  • sulfoxides
  • Substituents
  • aliphatic acyclic compound
  • organic oxide
  • sulfinyl compound
  • alpha-hydrogen aldehyde
  • sulfoxide
  • hydrocarbon derivative
  • organosulfur compound