Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:48:13 UTC
Update Date2025-03-25 00:49:27 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02174391
Frequency0.5
Structure
Chemical FormulaC16H22O2
Molecular Mass246.162
SMILESCCCCCCCC(O)=C(C=O)c1ccccc1
InChI KeyIDTCOXHYLGJNOD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass phenylacetaldehydes
Direct Parent phenylacetaldehydes
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • aldehydes
  • hydrocarbon derivatives
  • organic oxides
  • vinylogous acids
  • Substituents
  • aromatic homomonocyclic compound
  • vinylogous acid
  • carbonyl group
  • organic oxide
  • organic oxygen compound
  • aldehyde
  • hydrocarbon derivative
  • organooxygen compound
  • phenylacetaldehyde