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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:38:53 UTC
Update Date2025-03-25 00:46:05 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02153196
Frequency0.5
Structure
Chemical FormulaC10H16N2O7
Molecular Mass276.0958
SMILESNC(=O)CCC(NC(=O)OC1COCC1O)C(=O)O
InChI KeyJOTULSRQEYCDCN-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 heteromonocyclic compounds
Alternative Parents
  • alpha amino acids
  • carbamate esters
  • carbonyl compounds
  • carboxylic acids
  • dialkyl ethers
  • fatty amides
  • heterocyclic fatty acids
  • hydrocarbon derivatives
  • hydroxy fatty acids
  • monocarboxylic acids and derivatives
  • monosaccharides
  • organic carbonic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • primary carboxylic acid amides
  • secondary alcohols
  • short-chain hydroxy acids and derivatives
  • tetrahydrofurans
  • Substituents
  • primary carboxylic acid amide
  • fatty acyl
  • carbonyl group
  • ether
  • carboxylic acid
  • short-chain hydroxy acid
  • glutamine or derivatives
  • heterocyclic fatty acid
  • fatty amide
  • monosaccharide
  • fatty acid
  • dialkyl ether
  • saccharide
  • organic oxide
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • hydroxy fatty acid
  • organoheterocyclic compound
  • alcohol
  • carbonic acid derivative
  • tetrahydrofuran
  • carbamic acid ester
  • carboxamide group
  • oxacycle
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound