Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:42:26 UTC
Update Date2025-03-25 00:47:21 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02161155
Frequency0.5
Structure
Chemical FormulaC6H10N2O3
Molecular Mass158.0691
SMILESNCC(=O)C(=O)CCC(N)=O
InChI KeyYSRQLLRBSWUBJU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent alpha-diketones
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carboxylic acids and derivatives
  • fatty amides
  • hydrocarbon derivatives
  • monoalkylamines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • primary carboxylic acid amides
  • Substituents
  • primary carboxylic acid amide
  • fatty acyl
  • aliphatic acyclic compound
  • fatty amide
  • carboxamide group
  • carboxylic acid derivative
  • alpha-diketone
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound