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Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:37:31 UTC
Update Date2025-03-21 17:57:42 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00009683
Frequency494.5
Structure
Chemical FormulaC6H12NO7P
Molecular Mass241.0351
SMILESCC(=O)NC(C(=O)O)C(C)OP(=O)(O)O
InChI KeyVGLUAENHTSIACW-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent n-acyl-alpha amino acids
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • acetamides
  • alpha amino acids
  • carbonyl compounds
  • carboxylic acids
  • fatty acids and conjugates
  • hydrocarbon derivatives
  • monoalkyl phosphates
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • phosphoethanolamines
  • secondary carboxylic acid amides
  • short-chain hydroxy acids and derivatives
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • short-chain hydroxy acid
  • fatty acid
  • phosphoethanolamine
  • organic oxide
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • acetamide
  • n-acyl-alpha-amino acid
  • carboxamide group
  • secondary carboxylic acid amide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • phosphoric acid ester
  • monoalkyl phosphate
  • hydrocarbon derivative
  • organic nitrogen compound
  • organic phosphoric acid derivative
  • alkyl phosphate
  • organooxygen compound