Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:52:29 UTC
Update Date2025-03-21 18:03:28 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00044521
Frequency75.9
Structure
Chemical FormulaC18H20O2
Molecular Mass268.1463
SMILESCC(C(=O)O)c1ccc(C(C)(C)c2ccccc2)cc1
InChI KeyXVHZGOVAXPEYAL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass diphenylmethanes
Direct Parent diphenylmethanes
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • aromatic monoterpenoids
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • monocyclic monoterpenoids
  • organic oxides
  • phenylpropanes
  • phenylpropanoic acids
  • Substituents
  • diphenylmethane
  • monoterpenoid
  • carbonyl group
  • monocyclic monoterpenoid
  • carboxylic acid
  • p-cymene
  • carboxylic acid derivative
  • phenylpropane
  • aromatic homomonocyclic compound
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • 2-phenylpropanoic-acid
  • hydrocarbon derivative
  • organooxygen compound
  • aromatic monoterpenoid