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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:14:37 UTC
Update Date2025-03-21 18:33:42 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00097117
Frequency28.4
Structure
Chemical FormulaC6H11NO2S
Molecular Mass161.051
SMILESCC(O)C(O)C1=NCSC1
InChI KeyKMSFSPPEPRWHOG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazolines
Subclass thiazolines
Direct Parent thiazolines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • 1,2-diols
  • azacyclic compounds
  • dialkylthioethers
  • hydrocarbon derivatives
  • ketimines
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
  • secondary alcohols
    • Substituents
  • alcohol
  • ketimine
  • meta-thiazoline
  • azacycle
  • imine
  • dialkylthioether
  • organic 1,3-dipolar compound
  • propargyl-type 1,3-dipolar organic compound
  • organic oxygen compound
  • thioether
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • 1,2-diol