Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:00:38 UTC
Update Date2025-03-21 18:06:32 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00063636
Frequency48.5
Structure
Chemical FormulaC8H19N3O
Molecular Mass173.1528
SMILESCN(C)C(=O)C(N)CCCCN
InChI KeyVRKYOVZDXJOPDD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent alpha amino acid amides
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alpha amino acids
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • monoalkylamines
  • n-acyl amines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • tertiary carboxylic acid amides
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • alpha-amino acid amide
  • carboxamide group
  • n-acyl-amine
  • organic oxide
  • organic oxygen compound
  • tertiary carboxylic acid amide
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound