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Record Information
HMDB Statusexpected
Creation Date2024-02-20 23:40:19 UTC
Update Date2025-03-21 17:58:41 UTC
HMDB IDHMDB0028882
Metabolite Identification
DeepMet IDDMID00016091
NameHistidylcysteine
Frequency378.0
Structure
Chemical FormulaC9H14N4O3S
Molecular Mass258.0787
SMILESNC(Cc1c[nH]cn1)C(=O)NC(CS)C(=O)O
InChI KeyMAJYPBAJPNUFPV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent dipeptides
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • alkylthiols
  • alpha amino acid amides
  • alpha amino acids
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids
  • cysteine and derivatives
  • fatty amides
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidazoles
  • monoalkylamines
  • monocarboxylic acids and derivatives
  • n-acyl-alpha amino acids
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • organosulfur compounds
  • secondary carboxylic acid amides
  • Substituents
  • fatty acyl
  • carbonyl group
  • carboxylic acid
  • aromatic heteromonocyclic compound
  • fatty amide
  • alpha-amino acid or derivatives
  • organosulfur compound
  • organic oxide
  • imidazole
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • organoheterocyclic compound
  • azole
  • n-acyl-alpha amino acid or derivatives
  • alpha-amino acid amide
  • azacycle
  • n-acyl-alpha-amino acid
  • heteroaromatic compound
  • carboxamide group
  • alpha-dipeptide
  • secondary carboxylic acid amide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • cysteine or derivatives
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • alkylthiol
  • organooxygen compound