Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:21:31 UTC
Update Date2025-03-25 01:01:38 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02250572
Frequency0.5
Structure
Chemical FormulaC10H8O5
Molecular Mass208.0372
SMILESO=C1CC(C(=O)O)c2cc(O)cc(O)c21
InChI KeyVFQGIPALPZFFAL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classindanes
Subclass indanones
Direct Parent indanones
Geometric Descriptor aromatic homopolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • aryl alkyl ketones
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • vinylogous acids
  • Substituents
  • carbonyl group
  • carboxylic acid
  • aryl alkyl ketone
  • indanone
  • 1-hydroxy-2-unsubstituted benzenoid
  • aromatic homopolycyclic compound
  • 1-hydroxy-4-unsubstituted benzenoid
  • carboxylic acid derivative
  • ketone
  • vinylogous acid
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • hydrocarbon derivative
  • organooxygen compound
  • aryl ketone