Hmdb loader
Record Information
HMDB Statusexpected
Creation Date2024-02-20 23:35:03 UTC
Update Date2025-03-21 17:56:50 UTC
HMDB IDHMDB0242125
Metabolite Identification
DeepMet IDDMID00003978
Name((2-Amino-3-((2-amino-3-((carboxymethyl)amino)-3-oxopropyl)dithio)propanoyl)amino)acetic acid
Frequency1441.1
Structure
Chemical FormulaC10H18N4O6S2
Molecular Mass354.0668
SMILESNC(CSSCC(N)C(=O)NCC(=O)O)C(=O)NCC(=O)O
InChI KeyKDJVKDYFFTWHBO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent acyl glycines
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alpha amino acid amides
  • alpha amino acids
  • carbonyl compounds
  • carboxylic acids
  • cysteine and derivatives
  • dialkyldisulfides
  • dicarboxylic acids and derivatives
  • dipeptides
  • hydrocarbon derivatives
  • monoalkylamines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary carboxylic acid amides
  • sulfenyl compounds
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • organosulfur compound
  • alpha peptide
  • organic oxide
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • sulfenyl compound
  • alpha-amino acid amide
  • carboxamide group
  • n-acylglycine
  • alpha-dipeptide
  • secondary carboxylic acid amide
  • dialkyldisulfide
  • organic oxygen compound
  • organic disulfide
  • cysteine or derivatives
  • dicarboxylic acid or derivatives
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound