Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 02:51:06 UTC
Update Date2025-03-21 21:59:44 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00464239
Frequency3.8
Structure
Chemical FormulaC7H14NO+
Molecular Mass128.107
SMILESCCC(O)=CC=[N+](C)C
InChI KeyHPBKASIYSDDWNK-UHFFFAOYSA-O
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass organonitrogen compounds
Direct Parent organonitrogen compounds
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • organic cations
  • organooxygen compounds
  • organopnictogen compounds
  • Substituents
  • aliphatic acyclic compound
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic cation
  • organooxygen compound