Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:57:01 UTC
Update Date2025-03-25 00:52:32 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02194386
Frequency0.5
Structure
Chemical FormulaC20H42N2O3
Molecular Mass358.3195
SMILESCCCCCCCCCCCCCCCCNC(=O)C(O)C(N)CO
InChI KeyLCVCHDFOADEALU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent beta amino acids and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • monoalkylamines
  • monosaccharides
  • n-acyl amines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • primary alcohols
  • secondary alcohols
  • secondary carboxylic acid amides
  • Substituents
  • alcohol
  • fatty acyl
  • aliphatic acyclic compound
  • carbonyl group
  • fatty amide
  • monosaccharide
  • carboxamide group
  • n-acyl-amine
  • beta amino acid or derivatives
  • secondary carboxylic acid amide
  • saccharide
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • primary alcohol
  • organooxygen compound