Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:14:16 UTC
Update Date2025-03-21 18:33:31 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00096240
Frequency28.7
Structure
Chemical FormulaC10H8O4
Molecular Mass192.0423
SMILESO=C1CC(O)(C(=O)O)c2ccccc21
InChI KeyACQDJSPKPIYUDP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classindanes
Subclass indanones
Direct Parent indanones
Geometric Descriptor aromatic homopolycyclic compounds
Alternative Parents
  • alpha hydroxy acids and derivatives
  • aryl alkyl ketones
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • tertiary alcohols
  • Substituents
  • alcohol
  • carbonyl group
  • carboxylic acid
  • aryl alkyl ketone
  • alpha-hydroxy acid
  • indanone
  • aromatic homopolycyclic compound
  • hydroxy acid
  • carboxylic acid derivative
  • ketone
  • tertiary alcohol
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • hydrocarbon derivative
  • organooxygen compound
  • aryl ketone