Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 08:10:01 UTC
Update Date2025-03-24 22:31:47 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01227854
Frequency1.1
Structure
Chemical FormulaC8H13NO
Molecular Mass139.0997
SMILESCCC=CCC=CC(=N)O
InChI KeyHOOSILHCLPVFJU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboximidic acids and derivatives
Subclass carboximidic acids
Direct Parent carboximidic acids
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • Substituents
  • aliphatic acyclic compound
  • carboximidic acid
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound