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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:55:13 UTC
Update Date2025-03-25 00:51:56 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02190388
Frequency0.5
Structure
Chemical FormulaC5H8O2S2
Molecular Mass163.9966
SMILESCC(=O)C1SSCC1O
InChI KeyACRFIKJQOBFJCO-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
  • hydrocarbon derivatives
  • ketones
  • organic disulfides
  • organic oxides
  • secondary alcohols
    • Substituents
  • alcohol
  • carbonyl group
  • 1,2-dithiolane
  • ketone
  • organic oxide
  • organic oxygen compound
  • organic disulfide
  • aliphatic heteromonocyclic compound
  • secondary alcohol
  • hydrocarbon derivative
  • organooxygen compound