Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:28:01 UTC
Update Date2025-03-21 18:40:18 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00129488
Frequency19.6
Structure
Chemical FormulaC16H16O3
Molecular Mass256.1099
SMILESCC(C)(c1ccc(O)cc1)c1ccc(C(=O)O)cc1
InChI KeyDYAJVIKDIQWVAK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass diphenylmethanes
Direct Parent diphenylmethanes
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • benzoic acids
  • benzoyl derivatives
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organooxygen compounds
  • phenylpropanes
  • Substituents
  • diphenylmethane
  • carboxylic acid
  • benzoyl
  • 1-hydroxy-2-unsubstituted benzenoid
  • benzoic acid or derivatives
  • carboxylic acid derivative
  • phenylpropane
  • aromatic homomonocyclic compound
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • phenol
  • hydrocarbon derivative
  • benzoic acid
  • organooxygen compound