Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:20:51 UTC
Update Date2025-03-25 01:01:24 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02249028
Frequency0.5
Structure
Chemical FormulaC13H18O2
Molecular Mass206.1307
SMILESCOc1ccc2c(c1)C(O)CCC2(C)C
InChI KeyWITIOPWYSNLXHO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classtetralins
Subclass tetralins
Direct Parent tetralins
Geometric Descriptor aromatic homopolycyclic compounds
Alternative Parents
  • alkyl aryl ethers
  • anisoles
  • hydrocarbon derivatives
  • secondary alcohols
  • Substituents
  • alcohol
  • tetralin
  • phenol ether
  • ether
  • aromatic homopolycyclic compound
  • alkyl aryl ether
  • organic oxygen compound
  • anisole
  • secondary alcohol
  • hydrocarbon derivative
  • organooxygen compound