Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 08:11:02 UTC
Update Date2025-03-24 22:32:15 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01230389
Frequency1.1
Structure
Chemical FormulaC4H9N3O
Molecular Mass115.0746
SMILESCN1C(=O)CNC1N
InChI KeyFSLXGPLKMSQGRG-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 heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • dialkylamines
  • hydrocarbon derivatives
  • imidazolidinones
  • lactams
  • monoalkylamines
  • organic oxides
  • organopnictogen compounds
  • ortho amides
  • orthocarboxylic acid derivatives
  • tertiary carboxylic acid amides
  • Substituents
  • imidazolidine
  • carbonyl group
  • lactam
  • ortho amide
  • imidazolidinone
  • organic oxide
  • tertiary carboxylic acid amide
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • orthocarboxylic acid derivative
  • organoheterocyclic compound
  • secondary aliphatic amine
  • azacycle
  • secondary amine
  • carboxamide group
  • organic oxygen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound
  • amine