Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 07:42:05 UTC
Update Date2025-03-24 22:19:39 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01159101
Frequency1.2
Structure
Chemical FormulaC5H9NO2
Molecular Mass115.0633
SMILESCNC(=O)C=C(C)O
InChI KeyCDASTHKGLSHGJZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classfatty acyls
Subclass fatty amides
Direct Parent n-acyl amines
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary carboxylic acid amides
  • vinylogous acids
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • carboxamide group
  • carboxylic acid derivative
  • n-acyl-amine
  • secondary carboxylic acid amide
  • vinylogous acid
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound