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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:51:19 UTC
Update Date2025-03-25 00:50:32 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02181535
Frequency0.5
Structure
Chemical FormulaC12H17NO5
Molecular Mass255.1107
SMILESO=C(O)CCCCC1C(=O)N2C(C(=O)O)CCC12
InChI KeyUMYFGZMODDEHCO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classpeptidomimetics
Subclass hybrid peptides
Direct Parent hybrid peptides
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • alpha amino acids
  • amino fatty acids
  • azacyclic compounds
  • azepanes
  • azetidines
  • caprolactams
  • carbapenams
  • carbonyl compounds
  • carboxylic acids
  • dicarboxylic acids and derivatives
  • heterocyclic fatty acids
  • hydrocarbon derivatives
  • medium-chain fatty acids
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • pyrrolidine carboxylic acids
  • tertiary carboxylic acid amides
  • Substituents
  • fatty acyl
  • caprolactam
  • carbonyl group
  • lactam
  • carboxylic acid
  • heterocyclic fatty acid
  • fatty acid
  • alpha-amino acid or derivatives
  • carboxylic acid derivative
  • aliphatic heteropolycyclic compound
  • organic oxide
  • pyrrolidine carboxylic acid
  • tertiary carboxylic acid amide
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • medium-chain fatty acid
  • pyrrolidine
  • carbapenam
  • organoheterocyclic compound
  • cyclic hybrid peptide
  • azacycle
  • carboxamide group
  • amino fatty acid
  • azetidine
  • pyrrolidine carboxylic acid or derivatives
  • azepane
  • organic oxygen compound
  • dicarboxylic acid or derivatives
  • hydrocarbon derivative
  • organic nitrogen compound
  • beta-lactam
  • organooxygen compound