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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:41:06 UTC
Update Date2025-03-25 00:46:55 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02158240
Frequency0.5
Structure
Chemical FormulaC6H8N2O5S
Molecular Mass220.0154
SMILESO=C(O)CSC1NC(=O)NC1C(=O)O
InChI KeyNTUMNJANXHLLQC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent alpha amino acids
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids
  • dialkylthioethers
  • dicarboxylic acids and derivatives
  • hydrocarbon derivatives
  • imidazolidinones
  • organic carbonic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • sulfenyl compounds
  • thiohemiaminal derivatives
  • Substituents
  • imidazolidine
  • carbonyl group
  • carboxylic acid
  • organosulfur compound
  • imidazolidinone
  • organic oxide
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • alpha-amino acid
  • hemithioaminal
  • organopnictogen compound
  • organoheterocyclic compound
  • carbonic acid derivative
  • sulfenyl compound
  • azacycle
  • dialkylthioether
  • organic oxygen compound
  • thioether
  • dicarboxylic acid or derivatives
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound