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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:45:09 UTC
Update Date2025-03-25 00:48:18 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02167409
Frequency0.5
Structure
Chemical FormulaC7H10N2O3S
Molecular Mass202.0412
SMILESCC(=O)NCC1N=C(C(=O)O)CS1
InChI KeyGCFAUZHAABBPGY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazolines
Subclass thiazolines
Direct Parent thiazolines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • acetamides
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids
  • dialkylthioethers
  • hydrocarbon derivatives
  • ketimines
  • monocarboxylic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
  • secondary carboxylic acid amides
    • Substituents
  • ketimine
  • carbonyl group
  • carboxylic acid
  • meta-thiazoline
  • imine
  • carboxylic acid derivative
  • propargyl-type 1,3-dipolar organic compound
  • organic oxide
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • acetamide
  • azacycle
  • dialkylthioether
  • organic 1,3-dipolar compound
  • carboxamide group
  • secondary carboxylic acid amide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • thioether
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound