Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:35:06 UTC
Update Date2025-03-21 17:56:52 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00004102
Frequency1404.7
Structure
Chemical FormulaC8H14N2O5
Molecular Mass218.0903
SMILESNCCC(=O)NC(CCC(=O)O)C(=O)O
InChI KeyNXHRDLGRTFNFGH-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classpeptidomimetics
Subclass hybrid peptides
Direct Parent hybrid peptides
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alpha amino acids
  • beta amino acids and derivatives
  • carbonyl compounds
  • carboxylic acids
  • dicarboxylic acids and derivatives
  • fatty acids and conjugates
  • glutamic acid and derivatives
  • hydrocarbon derivatives
  • monoalkylamines
  • n-acyl-alpha amino acids
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary carboxylic acid amides
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • n-acyl-alpha-amino acid
  • fatty acid
  • alpha-amino acid or derivatives
  • glutamic acid or derivatives
  • carboxamide group
  • carboxylic acid derivative
  • beta amino acid or derivatives
  • secondary carboxylic acid amide
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • alpha-amino acid
  • dicarboxylic acid or derivatives
  • hybrid peptide
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound
  • n-acyl-alpha amino acid or derivatives