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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 06:13:00 UTC
Update Date2025-03-24 16:43:34 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00945451
Frequency1.5
Structure
Chemical FormulaC4H7NO2S
Molecular Mass133.0197
SMILESCC1=NCS(=O)(=O)C1
InChI KeyANHUUGXGHBLQQP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazolines
Subclass thiazolines
Direct Parent thiazolines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • hydrocarbon derivatives
  • ketimines
  • organic oxides
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
  • sulfones
    • Substituents
  • ketimine
  • meta-thiazoline
  • azacycle
  • imine
  • organic 1,3-dipolar compound
  • propargyl-type 1,3-dipolar organic compound
  • organic oxide
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • sulfone