Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:03:38 UTC
Update Date2025-03-25 00:54:57 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02209652
Frequency0.5
Structure
Chemical FormulaC9H14N2O6
Molecular Mass246.0852
SMILESCC(NC(=O)C(N)CCC(=O)O)C(=O)C(=O)O
InChI KeyQYPFIBUKJZQBMC-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 acid amides
  • alpha amino acids
  • alpha-hydroxy ketones
  • alpha-keto acids and derivatives
  • carboxylic acids
  • dicarboxylic acids and derivatives
  • glutamic acid and derivatives
  • hydrocarbon derivatives
  • monoalkylamines
  • n-acyl amines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary carboxylic acid amides
  • short-chain keto acids and derivatives
  • Substituents
  • fatty acyl
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • fatty amide
  • short-chain keto acid
  • alpha-amino acid or derivatives
  • alpha-hydroxy ketone
  • carboxylic acid derivative
  • ketone
  • organic oxide
  • organonitrogen compound
  • alpha-keto acid
  • alpha-amino acid
  • organopnictogen compound
  • alpha-amino acid amide
  • glutamic acid or derivatives
  • carboxamide group
  • n-acyl-amine
  • secondary carboxylic acid amide
  • organic oxygen compound
  • keto acid
  • dicarboxylic acid or derivatives
  • hybrid peptide
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound