Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 12:42:01 UTC
Update Date2025-03-24 21:44:44 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01876998
Frequency0.6
Structure
Chemical FormulaC4H5NO2
Molecular Mass99.032
SMILESC=CC(=O)C(N)=O
InChI KeyXYDCCJFDZNZRJD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass acryloyl compounds
Direct Parent acryloyl compounds
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carboxylic acids and derivatives
  • enones
  • hydrocarbon derivatives
  • ketones
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • primary carboxylic acid amides
  • Substituents
  • primary carboxylic acid amide
  • aliphatic acyclic compound
  • carbonyl group
  • alpha,beta-unsaturated ketone
  • carboxamide group
  • carboxylic acid derivative
  • ketone
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • acryloyl-group
  • organic nitrogen compound
  • enone