Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:25:30 UTC
Update Date2025-03-21 18:38:59 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00123500
Frequency20.9
Structure
Chemical FormulaC6H12N2O3
Molecular Mass160.0848
SMILESCC(=O)NCC(N)CC(=O)O
InChI KeyYUSAULZKCIPYHN-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
  • acetamides
  • carbonyl compounds
  • carboxylic acids
  • fatty acids and conjugates
  • hydrocarbon derivatives
  • monoalkylamines
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary carboxylic acid amides
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • fatty acid
  • carboxamide group
  • beta amino acid or derivatives
  • secondary carboxylic acid amide
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • acetamide
  • organooxygen compound