Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:37:40 UTC
Update Date2025-03-21 17:57:46 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00010061
Frequency472.2
Structure
Chemical FormulaC4H6O2S2
Molecular Mass149.9809
SMILESO=C(O)C1CCSS1
InChI KeySHMXLCRUTGTGGS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdithiolanes
Subclass 1,2-dithiolanes
Direct Parent 1,2-dithiolanes
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic disulfides
  • organic oxides
  • Substituents
  • carbonyl group
  • carboxylic acid
  • carboxylic acid derivative
  • 1,2-dithiolane
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • organic disulfide
  • aliphatic heteromonocyclic compound
  • hydrocarbon derivative
  • organooxygen compound