Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:58:45 UTC
Update Date2025-03-25 00:53:11 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02198372
Frequency0.5
Structure
Chemical FormulaC15H16O
Molecular Mass212.1201
SMILESCC1=C(C=CC(=O)c2ccccc2)CCC1
InChI KeyHVWFBOZYBPXJJJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass benzoyl derivatives
Direct Parent benzoyl derivatives
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • alpha,beta-unsaturated ketones
  • aryl ketones
  • hydrocarbon derivatives
  • organic oxides
  • organooxygen compounds
  • Substituents
  • ketone
  • aromatic homomonocyclic compound
  • organic oxide
  • organic oxygen compound
  • benzoyl
  • hydrocarbon derivative
  • alpha,beta-unsaturated ketone
  • organooxygen compound
  • aryl ketone