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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:51:02 UTC
Update Date2025-03-25 00:50:26 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02180897
Frequency0.5
Structure
Chemical FormulaC6H8N2O2S
Molecular Mass172.0306
SMILESO=C(O)CC1SCC2=NC1N2
InChI KeyYIGAXUBANNHSMX-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classthiazinanes
Subclass thiomorpholines
Direct Parent thiomorpholines
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • amidines
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids
  • dialkylthioethers
  • hydrocarbon derivatives
  • imidolactams
  • monocarboxylic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
    • Substituents
  • 1,4-thiazinane
  • carbonyl group
  • carboxylic acid
  • azacycle
  • dialkylthioether
  • organic 1,3-dipolar compound
  • amidine
  • carboxylic acid derivative
  • propargyl-type 1,3-dipolar organic compound
  • aliphatic heteropolycyclic compound
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • thioether
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • imidolactam
  • organooxygen compound