Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 11:22:24 UTC
Update Date2025-03-24 21:09:06 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01688007
Frequency0.7
Structure
Chemical FormulaC4H8N2O
Molecular Mass100.0637
SMILESNC(=O)C1CC1N
InChI KeyNYJLOBSPMAAEBN-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent beta amino acids and derivatives
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • carbonyl compounds
  • cyclopropanecarboxylic acids and derivatives
  • hydrocarbon derivatives
  • monoalkylamines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • primary carboxylic acid amides
  • Substituents
  • primary carboxylic acid amide
  • carbonyl group
  • cyclopropanecarboxylic acid or derivatives
  • carboxamide group
  • beta amino acid or derivatives
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • aliphatic homomonocyclic compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound