Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:17:45 UTC
Update Date2025-03-21 18:35:16 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00104828
Frequency41.9
Structure
Chemical FormulaC6H13N3O2
Molecular Mass159.1008
SMILESCN=C(N)CCC(N)C(=O)O
InChI KeyRRZKCYKNWNEDFG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent alpha amino acids
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • amidines
  • carbonyl compounds
  • carboximidamides
  • carboxylic acids
  • fatty acids and conjugates
  • 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
  • fatty acid
  • organic 1,3-dipolar compound
  • amidine
  • carboximidamide
  • propargyl-type 1,3-dipolar organic compound
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound