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Record Information
HMDB Statusdetected
Creation Date2024-02-20 23:33:30 UTC
Update Date2025-03-21 17:56:07 UTC
HMDB IDHMDB0028986
Metabolite Identification
DeepMet IDDMID00000260
NameMethionyl-Valine
Frequency17481.4
Structure
Chemical FormulaC10H20N2O3S
Molecular Mass248.1195
SMILESCSCCC(N)C(=O)NC(C(=O)O)C(C)C
InChI KeyBJFJQOMZCSHBMY-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 aliphatic acyclic compounds
Alternative Parents
  • alpha amino acid amides
  • alpha amino acids
  • carbonyl compounds
  • carboxylic acids
  • dialkylthioethers
  • hydrocarbon derivatives
  • methionine and derivatives
  • methyl-branched fatty acids
  • monoalkylamines
  • monocarboxylic acids and derivatives
  • n-acyl amines
  • n-acyl-alpha amino acids
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary carboxylic acid amides
  • sulfenyl compounds
  • valine and derivatives
  • Substituents
  • fatty acyl
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • fatty amide
  • fatty acid
  • alpha-amino acid or derivatives
  • organosulfur compound
  • organic oxide
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • n-acyl-alpha amino acid or derivatives
  • methyl-branched fatty acid
  • sulfenyl compound
  • alpha-amino acid amide
  • n-acyl-alpha-amino acid
  • dialkylthioether
  • valine or derivatives
  • carboxamide group
  • branched fatty acid
  • n-acyl-amine
  • alpha-dipeptide
  • secondary carboxylic acid amide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • thioether
  • methionine or derivatives
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound