Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 01:41:17 UTC
Update Date2025-03-21 20:00:46 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00299499
Frequency6.6
Structure
Chemical FormulaC5H9NO2
Molecular Mass115.0633
SMILESCCC(N)C(O)=C=O
InChI KeyWKTXYCPMUCURLO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass ynolates
Direct Parent ynolates
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • monoalkylamines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • aliphatic acyclic compound
  • organic oxide
  • ynolate
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound