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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:14:01 UTC
Update Date2025-03-25 00:58:52 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02233307
Frequency0.5
Structure
Chemical FormulaC8H16N2O3S2
Molecular Mass252.0602
SMILESCSCCC(N)C(=O)N1CCS(=O)(=O)C1
InChI KeySDIJOFLIMYXXNV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent methionine and derivatives
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • alpha amino acid amides
  • alpha amino acids
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • dialkylthioethers
  • hydrocarbon derivatives
  • monoalkylamines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • sulfenyl compounds
  • sulfones
  • tertiary carboxylic acid amides
  • thiazolidines
  • Substituents
  • carbonyl group
  • organosulfur compound
  • organic oxide
  • tertiary carboxylic acid amide
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • organoheterocyclic compound
  • sulfenyl compound
  • alpha-amino acid amide
  • azacycle
  • dialkylthioether
  • carboxamide group
  • organic oxygen compound
  • thioether
  • methionine or derivatives
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound
  • sulfone
  • thiazolidine