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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:00:28 UTC
Update Date2025-03-25 00:53:50 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02202327
Frequency0.5
Structure
Chemical FormulaC6H17NOS2
Molecular Mass183.0752
SMILESC[SH](C)(=O)CCSCCN
InChI KeySVAVHAPYUMPMDN-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganosulfur compounds
Classthiols
Subclass alkylthiols
Direct Parent alkylthiols
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • dialkylthioethers
  • hydrocarbon derivatives
  • monoalkylamines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • sulfenyl compounds
    • Substituents
  • aliphatic acyclic compound
  • sulfenyl compound
  • dialkylthioether
  • organic oxide
  • organic oxygen compound
  • thioether
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • alkylthiol