Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 04:05:40 UTC
Update Date2025-03-21 23:07:22 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00640639
Frequency2.5
Structure
Chemical FormulaC6H12N2O2
Molecular Mass144.0899
SMILESCC(N)C=NC(C)C(=O)O
InChI KeyJFQFSCFIZBOLLI-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent alanine and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • aldimines
  • alpha amino acids
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monoalkylamines
  • monocarboxylic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • imine
  • organic 1,3-dipolar compound
  • propargyl-type 1,3-dipolar organic compound
  • aldimine
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • alanine or derivatives
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound