Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:54:26 UTC
Update Date2025-03-25 00:51:41 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02188610
Frequency0.5
Structure
Chemical FormulaC9H19N3O4
Molecular Mass233.1376
SMILESCC(N)C(=O)NNC(=O)C(O)C(C)(C)CO
InChI KeyWJIYVMMRHLOUEL-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
  • alpha amino acids
  • carbonyl compounds
  • carboxylic acids and derivatives
  • diacylhydrazines
  • hydrocarbon derivatives
  • monoalkylamines
  • monosaccharides
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary alcohols
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • carboxylic acid hydrazide
  • carbonyl group
  • monosaccharide
  • diacylhydrazine
  • saccharide
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • alpha-amino acid
  • secondary alcohol
  • organopnictogen compound
  • alanine or derivatives
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound