Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:27:29 UTC
Update Date2025-03-21 18:40:02 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00128213
Frequency19.9
Structure
Chemical FormulaC9H20N2O4
Molecular Mass220.1423
SMILESCC(O)C(N)C(=O)NC(C(C)O)C(C)O
InChI KeyLDNQBYRUUQTHCZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent alpha amino acid amides
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alpha amino acids
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • monoalkylamines
  • n-acyl amines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary alcohols
  • secondary carboxylic acid amides
  • Substituents
  • alcohol
  • fatty acyl
  • aliphatic acyclic compound
  • carbonyl group
  • alpha-amino acid amide
  • fatty amide
  • carboxamide group
  • n-acyl-amine
  • secondary carboxylic acid amide
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • alpha-amino acid
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound