Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:49:25 UTC
Update Date2025-03-21 18:02:15 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00037178
Frequency94.8
Structure
Chemical FormulaC6H12N2O4S2
Molecular Mass240.0238
SMILESNC(O)C(=O)CSSCC(N)C(=O)O
InChI KeyFDVGUHGBMOHNQL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent cysteine and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alkanolamines
  • alpha amino acids
  • alpha-hydroxy ketones
  • carboxylic acids
  • dialkyldisulfides
  • hydrocarbon derivatives
  • monoalkylamines
  • monocarboxylic acids and derivatives
  • monosaccharides
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • sulfenyl compounds
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • monosaccharide
  • organosulfur compound
  • alpha-hydroxy ketone
  • ketone
  • saccharide
  • organic oxide
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • alkanolamine
  • sulfenyl compound
  • dialkyldisulfide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • organic disulfide
  • cysteine or derivatives
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound