Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 17:21:10 UTC
Update Date2025-03-25 01:48:59 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02527924
Frequency0.5
Structure
Chemical FormulaC7H9NO2
Molecular Mass139.0633
SMILESC=CCNC(=C=O)C(C)=O
InChI KeyXFJAGRPIBSUBLN-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
  • dialkylamines
  • enones
  • hydrocarbon derivatives
  • ketones
  • organic oxides
  • organopnictogen compounds
  • ynolates
  • Substituents
  • aliphatic acyclic compound
  • secondary aliphatic amine
  • carbonyl group
  • secondary amine
  • ketone
  • organic oxide
  • ynolate
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • acryloyl-group
  • organic nitrogen compound
  • amine
  • enone