Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:39:51 UTC
Update Date2025-03-21 17:58:32 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00015101
Frequency289.3
Structure
Chemical FormulaC5H8OS
Molecular Mass116.0296
SMILESC=CCSCC=O
InChI KeyUDPDMDAUIWISCF-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganosulfur compounds
Classallyl sulfur compounds
Subclass allyl sulfur compounds
Direct Parent allyl sulfur compounds
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • aldehydes
  • dialkylthioethers
  • hydrocarbon derivatives
  • organic oxides
  • sulfenyl compounds
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • sulfenyl compound
  • dialkylthioether
  • allyl sulfur compound
  • aldehyde
  • organic oxide
  • organic oxygen compound
  • thioether
  • hydrocarbon derivative
  • organooxygen compound