Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:39:04 UTC
Update Date2025-03-25 00:46:10 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02153649
Frequency0.5
Structure
Chemical FormulaC7H14O2S2
Molecular Mass194.0435
SMILESCC(=O)CSCCCS(C)=O
InChI KeyXNNUGXJVCUJIPB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganosulfur compounds
Classsulfoxides
Subclass sulfoxides
Direct Parent sulfoxides
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • dialkylthioethers
  • hydrocarbon derivatives
  • ketones
  • organic oxides
  • sulfenyl compounds
  • sulfinyl compounds
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • sulfenyl compound
  • dialkylthioether
  • ketone
  • organic oxide
  • organic oxygen compound
  • sulfinyl compound
  • thioether
  • sulfoxide
  • hydrocarbon derivative
  • organooxygen compound