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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:10:56 UTC
Update Date2025-03-25 00:57:44 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02226494
Frequency0.5
Structure
Chemical FormulaC7H12N2O5
Molecular Mass204.0746
SMILESCC(N)C(=O)NC(=O)C(O)CC(=O)O
InChI KeyZZPSLMZIWRLHCY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent alpha amino acid amides
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alanine and derivatives
  • alpha amino acids
  • beta hydroxy acids and derivatives
  • carbonyl compounds
  • carboxylic acids
  • dicarboximides
  • hydrocarbon derivatives
  • hydroxy fatty acids
  • monoalkylamines
  • monocarboxylic acids and derivatives
  • n-acyl amines
  • n-unsubstituted carboxylic acid imides
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary alcohols
  • short-chain hydroxy acids and derivatives
  • Substituents
  • fatty acyl
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • short-chain hydroxy acid
  • fatty acid
  • carboxylic acid imide, n-unsubstituted
  • beta-hydroxy acid
  • organic oxide
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • hydroxy fatty acid
  • dicarboximide
  • alcohol
  • alpha-amino acid amide
  • hydroxy acid
  • n-acyl-amine
  • carboxylic acid imide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • secondary alcohol
  • alanine or derivatives
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound