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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:42:42 UTC
Update Date2025-03-25 00:47:26 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02161728
Frequency0.5
Structure
Chemical FormulaC12H21N3O4
Molecular Mass271.1532
SMILESNCCCCC(NC(=O)C1CCCNC1=O)C(=O)O
InChI KeyKVNLPWLWFNSKEB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent n-acyl-alpha amino acids
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • 1,3-dicarbonyl compounds
  • alpha amino acids
  • amino fatty acids
  • azacyclic compounds
  • carboxylic acids
  • delta lactams
  • heterocyclic fatty acids
  • hydrocarbon derivatives
  • medium-chain fatty acids
  • monoalkylamines
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • piperidinecarboxamides
  • piperidinones
  • secondary carboxylic acid amides
  • Substituents
  • fatty acyl
  • carbonyl group
  • lactam
  • carboxylic acid
  • heterocyclic fatty acid
  • fatty acid
  • organic oxide
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • piperidinone
  • medium-chain fatty acid
  • piperidine
  • organoheterocyclic compound
  • azacycle
  • n-acyl-alpha-amino acid
  • piperidinecarboxamide
  • 3-piperidinecarboxamide
  • carboxamide group
  • amino fatty acid
  • delta-lactam
  • secondary carboxylic acid amide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • 1,3-dicarbonyl compound
  • organooxygen compound