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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:08:46 UTC
Update Date2025-03-25 00:56:56 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02221651
Frequency0.5
Structure
Chemical FormulaC12H17N3O7
Molecular Mass315.1066
SMILESO=C(O)CCC(NC(=O)CCCC1NC(=O)NC1=O)C(=O)O
InChI KeyYUIDIGBBQDFPIY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent glutamic acid and derivatives
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • alpha amino acids
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids
  • dicarboximides
  • dicarboxylic acids and derivatives
  • heterocyclic fatty acids
  • hydantoins
  • hydrocarbon derivatives
  • imidazolidinones
  • n-acyl amines
  • n-acyl-alpha amino acids
  • organic carbonic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary carboxylic acid amides
  • Substituents
  • imidazolidine
  • fatty acyl
  • carbonyl group
  • carboxylic acid
  • heterocyclic fatty acid
  • fatty amide
  • fatty acid
  • imidazolidinone
  • organic oxide
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • dicarboximide
  • organoheterocyclic compound
  • n-acyl-alpha amino acid or derivatives
  • carbonic acid derivative
  • azacycle
  • n-acyl-alpha-amino acid
  • glutamic acid or derivatives
  • carboxamide group
  • n-acyl-amine
  • secondary carboxylic acid amide
  • organic oxygen compound
  • hydantoin
  • dicarboxylic acid or derivatives
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound