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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:59:17 UTC
Update Date2025-03-25 00:53:26 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02199602
Frequency0.5
Structure
Chemical FormulaC7H13N3O4
Molecular Mass203.0906
SMILESNC(=O)CCC(=O)NC(=O)C(N)CO
InChI KeySXNFOIKHDIMPPF-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
  • alpha amino acids
  • carbonyl compounds
  • carboxylic acids and derivatives
  • dicarboximides
  • hydrocarbon derivatives
  • monoalkylamines
  • n-acyl amines
  • n-unsubstituted carboxylic acid imides
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • primary alcohols
  • primary carboxylic acid amides
  • serine and derivatives
  • Substituents
  • primary carboxylic acid amide
  • fatty acyl
  • aliphatic acyclic compound
  • carbonyl group
  • fatty amide
  • carboxylic acid imide, n-unsubstituted
  • organic oxide
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • dicarboximide
  • primary alcohol
  • alcohol
  • alpha-amino acid amide
  • carboxamide group
  • n-acyl-amine
  • carboxylic acid imide
  • organic oxygen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • serine or derivatives
  • organooxygen compound