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 IDDMID00123488
Frequency20.9
Structure
Chemical FormulaC6H13N3O2
Molecular Mass159.1008
SMILESCN(C)C(=O)C(N)CC(N)=O
InChI KeyNHTRRDMCJUNSGW-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent asparagine and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alpha amino acid amides
  • alpha amino acids
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • monoalkylamines
  • n-acyl amines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • primary carboxylic acid amides
  • tertiary carboxylic acid amides
  • Substituents
  • primary carboxylic acid amide
  • fatty acyl
  • aliphatic acyclic compound
  • carbonyl group
  • alpha-amino acid amide
  • fatty amide
  • carboxamide group
  • n-acyl-amine
  • organic oxide
  • organic oxygen compound
  • tertiary carboxylic acid amide
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • asparagine or derivatives
  • organic nitrogen compound
  • organooxygen compound