Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:58:57 UTC
Update Date2025-03-25 00:53:16 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02198834
Frequency0.5
Structure
Chemical FormulaC18H16O5
Molecular Mass312.0998
SMILESCCOC1=C(O)C(=O)OC1(c1ccccc1)c1ccc(O)cc1
InChI KeyVGPLJFBAMYCEON-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass diphenylmethanes
Direct Parent diphenylmethanes
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • butenolides
  • carbonyl compounds
  • dihydrofurans
  • enoate esters
  • hydrocarbon derivatives
  • lactones
  • monocarboxylic acids and derivatives
  • monosaccharides
  • organic oxides
  • oxacyclic compounds
  • vinylogous esters
  • Substituents
  • diphenylmethane
  • carbonyl group
  • aromatic heteromonocyclic compound
  • 1-hydroxy-2-unsubstituted benzenoid
  • monosaccharide
  • carboxylic acid derivative
  • lactone
  • alpha,beta-unsaturated carboxylic ester
  • 2-furanone
  • saccharide
  • organic oxide
  • organoheterocyclic compound
  • dihydrofuran
  • enoate ester
  • vinylogous ester
  • oxacycle
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • phenol
  • hydrocarbon derivative
  • organooxygen compound