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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:18:03 UTC
Update Date2025-03-21 18:35:26 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00105563
Frequency25.6
Structure
Chemical FormulaC20H26N2O7
Molecular Mass406.174
SMILESO=C(O)CCC(NC(=O)c1ccc(NCC2CCC(C(=O)O)CC2)cc1)C(=O)O
InChI KeyFJRNUZDEONWDCO-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 aromatic homomonocyclic compounds
Alternative Parents
  • alpha amino acids
  • amino acids
  • benzoyl derivatives
  • carbonyl compounds
  • carboxylic acids
  • hippuric acids and derivatives
  • hydrocarbon derivatives
  • n-acyl-alpha amino acids
  • organic oxides
  • organopnictogen compounds
  • phenylalkylamines
  • secondary alkylarylamines
  • secondary carboxylic acid amides
  • tricarboxylic acids and derivatives
  • Substituents
  • monocyclic benzene moiety
  • carbonyl group
  • carboxylic acid
  • amino acid
  • benzoyl
  • tricarboxylic acid or derivatives
  • benzamide
  • organic oxide
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • n-acyl-alpha amino acid or derivatives
  • n-acyl-alpha-amino acid
  • hippuric acid or derivatives
  • benzoic acid or derivatives
  • glutamic acid or derivatives
  • secondary amine
  • carboxamide group
  • secondary aliphatic/aromatic amine
  • aromatic homomonocyclic compound
  • secondary carboxylic acid amide
  • organic oxygen compound
  • phenylalkylamine
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • amine
  • organooxygen compound