Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:48:38 UTC
Update Date2025-03-21 18:01:53 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00035239
Frequency101.3
Structure
Chemical FormulaC5H8O2S2
Molecular Mass163.9966
SMILESO=C(O)C1CSCSC1
InChI KeyGLGWJBJPEUJTFI-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdithianes
Subclass dithianes
Direct Parent dithianes
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids
  • dialkylthioethers
  • dithioacetals
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • Substituents
  • carbonyl group
  • carboxylic acid
  • 1,3-dithiane
  • dialkylthioether
  • carboxylic acid derivative
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • thioether
  • aliphatic heteromonocyclic compound
  • hydrocarbon derivative
  • thioacetal
  • organooxygen compound