Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:43:46 UTC
Update Date2025-03-25 00:47:49 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02164188
Frequency0.5
Structure
Chemical FormulaC16H16O3
Molecular Mass256.1099
SMILESCC(O)C(=O)OC(c1ccccc1)c1ccccc1
InChI KeyGQGDECQOLWXZPG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass diphenylmethanes
Direct Parent diphenylmethanes
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • benzyloxycarbonyls
  • carbonyl compounds
  • carboxylic acid esters
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • secondary alcohols
  • Substituents
  • benzyloxycarbonyl
  • alcohol
  • diphenylmethane
  • carbonyl group
  • carboxylic acid derivative
  • aromatic homomonocyclic compound
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • secondary alcohol
  • hydrocarbon derivative
  • organooxygen compound