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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:57:58 UTC
Update Date2025-03-25 00:52:52 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02196542
Frequency0.5
Structure
Chemical FormulaC29H39N5O6
Molecular Mass553.29
SMILESCCC1=C(C)C(=O)NC1Cc1nc(C(=O)O)c(Cc2[nH]c(CC3NC(=O)C(CC)C3C)c(C)c2CCC(=O)O)[nH]1
InChI KeyYOIXIJAOGJPVMJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazoles
Subclass imidazoles
Direct Parent 2,4,5-trisubstituted imidazoles
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • carbonylimidazoles
  • carboxylic acids
  • dicarboxylic acids and derivatives
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidazoles
  • lactams
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • pyrroles
  • pyrrolidine-2-ones
  • pyrrolines
  • secondary carboxylic acid amides
  • vinylogous amides
    • Substituents
  • 2-pyrrolidone
  • carbonyl group
  • lactam
  • carboxylic acid
  • aromatic heteromonocyclic compound
  • carboxylic acid derivative
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • imidazole-4-carbonyl group
  • pyrrolidine
  • pyrrolidone
  • vinylogous amide
  • azacycle
  • heteroaromatic compound
  • 2,4,5-trisubstituted-imidazole
  • carboxamide group
  • secondary carboxylic acid amide
  • organic oxygen compound
  • pyrroline
  • pyrrole
  • dicarboxylic acid or derivatives
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound