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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:00:29 UTC
Update Date2025-03-25 00:53:51 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02202368
Frequency0.5
Structure
Chemical FormulaC9H15N3O3S
Molecular Mass245.0834
SMILESCSCCC1NC(C(=O)O)C2NC(=O)NC12
InChI KeyYFGLASVKQZVZCN-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 heteropolycyclic compounds
Alternative Parents
  • amino acids
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids
  • dialkylamines
  • dialkylthioethers
  • hydrocarbon derivatives
  • imidazolidinones
  • monocarboxylic acids and derivatives
  • organic carbonic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • pyrrolidine carboxylic acids
  • sulfenyl compounds
  • Substituents
  • imidazolidine
  • carbonyl group
  • carboxylic acid
  • amino acid
  • organosulfur compound
  • aliphatic heteropolycyclic compound
  • imidazolidinone
  • organic oxide
  • pyrrolidine carboxylic acid
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • pyrrolidine
  • organoheterocyclic compound
  • secondary aliphatic amine
  • carbonic acid derivative
  • sulfenyl compound
  • azacycle
  • dialkylthioether
  • secondary amine
  • monocarboxylic acid or derivatives
  • pyrrolidine carboxylic acid or derivatives
  • organic oxygen compound
  • thioether
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • amine