Hmdb loader

Showing information for DMID02252821

Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:22:30 UTC
Update Date2025-03-25 01:01:58 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02252821
Frequency0.5
Structure
Chemical FormulaC12H20N4O7
Molecular Mass332.1332
SMILESNC(CCCN=C(NC(=O)CCC(N)C(=O)O)C(=O)O)C(=O)O
InChI KeyJFVZAAYCYHIVLJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent glutamine and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alpha amino acids
  • carbonyl compounds
  • carboximidamides
  • carboxylic acids
  • hydrocarbon derivatives
  • monoalkylamines
  • n-acyl amines
  • n-acyl-alpha amino acids
  • organic oxides
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
  • tricarboxylic acids and derivatives
    • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • glutamine or derivatives
  • n-acyl-alpha-amino acid
  • tricarboxylic acid or derivatives
  • organic 1,3-dipolar compound
  • carboximidamide
  • n-acyl-amine
  • propargyl-type 1,3-dipolar organic compound
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound
  • n-acyl-alpha amino acid or derivatives