Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:47:42 UTC
Update Date2025-03-25 00:49:17 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02173208
Frequency0.5
Structure
Chemical FormulaC9H16N2O3+
Molecular Mass200.1155
SMILESCCC(C)C(NC(=O)C(=O)O)C(C)[N+]
InChI KeyJWLYEXUIVFFTNC-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
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic cations
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary carboxylic acid amides
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • carboxamide group
  • secondary carboxylic acid amide
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organic cation
  • organooxygen compound