Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:02:23 UTC
Update Date2025-03-25 00:54:29 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02206675
Frequency0.5
Structure
Chemical FormulaC16H14O5
Molecular Mass286.0841
SMILESO=C(COC(=O)c1ccc(O)cc1)Cc1cccc(O)c1
InChI KeyKPZANAGBESFUBP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass benzoic acids and derivatives
Direct Parent p-hydroxybenzoic acid alkyl esters
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • benzoyl derivatives
  • carboxylic acid esters
  • hydrocarbon derivatives
  • ketones
  • monocarboxylic acids and derivatives
  • organic oxides
  • Substituents
  • carbonyl group
  • benzoyl
  • 1-hydroxy-2-unsubstituted benzenoid
  • 1-hydroxy-4-unsubstituted benzenoid
  • carboxylic acid derivative
  • p-hydroxybenzoic acid alkyl ester
  • ketone
  • aromatic homomonocyclic compound
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • phenol
  • hydrocarbon derivative
  • organooxygen compound