Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 03:38:12 UTC
Update Date2025-03-21 22:52:30 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00576062
Frequency2.8
Structure
Chemical FormulaC5H12N2O
Molecular Mass116.095
SMILESCNC(C)CC(N)=O
InChI KeyZCCUVFCTQSVYRF-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 acyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids and derivatives
  • dialkylamines
  • fatty amides
  • hydrocarbon derivatives
  • organic oxides
  • organopnictogen compounds
  • primary carboxylic acid amides
  • Substituents
  • primary carboxylic acid amide
  • fatty acyl
  • aliphatic acyclic compound
  • secondary aliphatic amine
  • carbonyl group
  • fatty amide
  • secondary amine
  • carboxamide group
  • beta amino acid or derivatives
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • amine