Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:14:00 UTC
Update Date2025-03-25 00:58:52 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02233287
Frequency0.5
Structure
Chemical FormulaC14H19NO2
Molecular Mass233.1416
SMILESCCCCCCC=Nc1ccc(C(=O)O)cc1
InChI KeyFEDBEPAADQYNOG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass benzoic acids and derivatives
Direct Parent benzoic acids
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • aldimines
  • benzoyl derivatives
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organooxygen compounds
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
  • Substituents
  • carboxylic acid
  • imine
  • benzoyl
  • organic 1,3-dipolar compound
  • carboxylic acid derivative
  • propargyl-type 1,3-dipolar organic compound
  • aromatic homomonocyclic compound
  • aldimine
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • benzoic acid
  • organooxygen compound