Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:39:51 UTC
Update Date2025-03-25 00:46:29 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02155498
Frequency0.5
Structure
Chemical FormulaC13H16O2
Molecular Mass204.115
SMILESCc1ccc2c(c1)C(=O)C(O)CC2(C)C
InChI KeyPWJQRQWSWHYCOA-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classtetralins
Subclass tetralins
Direct Parent tetralins
Geometric Descriptor aromatic homopolycyclic compounds
Alternative Parents
  • aryl alkyl ketones
  • hydrocarbon derivatives
  • organic oxides
  • secondary alcohols
  • Substituents
  • alcohol
  • tetralin
  • aryl alkyl ketone
  • aromatic homopolycyclic compound
  • ketone
  • organic oxide
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • organooxygen compound
  • aryl ketone