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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:42:23 UTC
Update Date2025-03-25 00:47:20 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02161027
Frequency0.5
Structure
Chemical FormulaC7H9N3O5
Molecular Mass215.0542
SMILESNC1C(=O)NC(=O)C(CC(=O)O)NC1=O
InChI KeyKJPHQQVZNLXERD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent cyclic peptides
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • 1,3-dicarbonyl compounds
  • 1,4-diazepanes
  • alpha amino acids
  • azacyclic compounds
  • carboxylic acids
  • dicarboximides
  • dipeptides
  • hydrocarbon derivatives
  • lactams
  • monoalkylamines
  • monocarboxylic acids and derivatives
  • n-unsubstituted carboxylic acid imides
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary carboxylic acid amides
  • Substituents
  • carbonyl group
  • lactam
  • carboxylic acid
  • 1,4-diazepane
  • diazepane
  • alpha-amino acid or derivatives
  • carboxylic acid imide, n-unsubstituted
  • organic oxide
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • dicarboximide
  • organoheterocyclic compound
  • azacycle
  • carboxamide group
  • carboxylic acid imide
  • alpha-dipeptide
  • secondary carboxylic acid amide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • cyclic alpha peptide
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • 1,3-dicarbonyl compound
  • organooxygen compound