Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:42:59 UTC
Update Date2025-03-25 00:47:32 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02162374
Frequency0.5
Structure
Chemical FormulaC17H16O3
Molecular Mass268.1099
SMILESO=C(O)CC1c2ccccc2CCc2ccc(O)cc21
InChI KeyHYOKBDLBRXPRCA-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classdibenzocycloheptenes
Subclass dibenzocycloheptenes
Direct Parent dibenzocycloheptenes
Geometric Descriptor aromatic homopolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • Substituents
  • carbonyl group
  • carboxylic acid
  • 1-hydroxy-2-unsubstituted benzenoid
  • aromatic homopolycyclic compound
  • carboxylic acid derivative
  • dibenzocycloheptene
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • hydrocarbon derivative
  • organooxygen compound