Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:15:57 UTC
Update Date2025-03-21 18:34:20 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00100364
Frequency27.3
Structure
Chemical FormulaC18H19FO2
Molecular Mass286.1369
SMILESCC(C(=O)O)c1cccc(C(C)(C)c2ccc(F)cc2)c1
InChI KeyOAIIMCMVZLOFFN-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass diphenylmethanes
Direct Parent diphenylmethanes
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • aryl fluorides
  • carbonyl compounds
  • carboxylic acids
  • fluorobenzenes
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organofluorides
  • phenylpropanes
  • phenylpropanoic acids
  • Substituents
  • aryl fluoride
  • diphenylmethane
  • carbonyl group
  • carboxylic acid
  • organofluoride
  • carboxylic acid derivative
  • organohalogen compound
  • aryl halide
  • phenylpropane
  • aromatic homomonocyclic compound
  • fluorobenzene
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • 2-phenylpropanoic-acid
  • hydrocarbon derivative
  • halobenzene
  • organooxygen compound