Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:42:26 UTC
Update Date2025-03-21 17:59:24 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00020768
Frequency194.3
Structure
Chemical FormulaC6H10OS
Molecular Mass130.0452
SMILESC=CCSCC(C)=O
InChI KeyDKTGCNYUFLGDPK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent ketones
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • allyl sulfur compounds
  • dialkylthioethers
  • hydrocarbon derivatives
  • organic oxides
  • sulfenyl compounds
  • Substituents
  • aliphatic acyclic compound
  • sulfenyl compound
  • dialkylthioether
  • allyl sulfur compound
  • organosulfur compound
  • ketone
  • organic oxide
  • thioether
  • hydrocarbon derivative