Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:12:39 UTC
Update Date2025-03-25 00:58:21 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02230176
Frequency0.5
Structure
Chemical FormulaC6H12N2O3
Molecular Mass160.0848
SMILESCN(C)CC(C(N)=O)C(=O)O
InChI KeyVZBTUMXRTNQSHV-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
  • 1,3-dicarbonyl compounds
  • amino acids
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • primary carboxylic acid amides
  • trialkylamines
  • Substituents
  • primary carboxylic acid amide
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • amino acid
  • tertiary aliphatic amine
  • carboxamide group
  • beta amino acid or derivatives
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • 1,3-dicarbonyl compound
  • amine
  • tertiary amine
  • organooxygen compound