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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:14:12 UTC
Update Date2025-03-25 00:58:55 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02233750
Frequency0.5
Structure
Chemical FormulaC11H13NO5
Molecular Mass239.0794
SMILESCC1=C(CC2CCC(=O)O2)C(=O)NC1C(=O)O
InChI KeyHADDBVOELHHEAH-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classpeptidomimetics
Subclass hybrid peptides
Direct Parent hybrid peptides
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • alpha amino acids
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acid esters
  • carboxylic acids
  • dicarboxylic acids and derivatives
  • gamma butyrolactones
  • hydrocarbon derivatives
  • lactams
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • pyrroline 2-carboxylic acids
  • secondary carboxylic acid amides
  • tetrahydrofurans
  • Substituents
  • carbonyl group
  • lactam
  • carboxylic acid
  • alpha-amino acid or derivatives
  • carboxylic acid derivative
  • lactone
  • organic oxide
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • organoheterocyclic compound
  • cyclic hybrid peptide
  • azacycle
  • tetrahydrofuran
  • pyrroline carboxylic acid or derivatives
  • carboxamide group
  • pyrroline 2-carboxylic acid
  • gamma butyrolactone
  • oxacycle
  • secondary carboxylic acid amide
  • organic oxygen compound
  • pyrroline
  • pyrroline carboxylic acid
  • carboxylic acid ester
  • dicarboxylic acid or derivatives
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound