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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 11:26:06 UTC
Update Date2025-03-24 21:10:46 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01696868
Frequency0.7
Structure
Chemical FormulaC5H7NS2
Molecular Mass145.002
SMILESC1CC2CSSC2=N1
InChI KeyCRTPBVYAYGHLEU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdithiolanes
Subclass 1,2-dithiolanes
Direct Parent 1,2-dithiolanes
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • hydrocarbon derivatives
  • organic disulfides
  • organonitrogen compounds
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
  • pyrrolines
    • Substituents
  • azacycle
  • organic 1,3-dipolar compound
  • 1,2-dithiolane
  • propargyl-type 1,3-dipolar organic compound
  • aliphatic heteropolycyclic compound
  • pyrroline
  • organic disulfide
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound