Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:37:39 UTC
Update Date2025-03-25 00:45:38 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02150310
Frequency0.5
Structure
Chemical FormulaC13H16O2
Molecular Mass204.115
SMILESC=CC1(O)CCCc2ccc(OC)cc21
InChI KeyVPAGFXGTOAJPBY-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
  • tertiary alcohols
  • Substituents
  • alcohol
  • tetralin
  • phenol ether
  • ether
  • aromatic homopolycyclic compound
  • alkyl aryl ether
  • tertiary alcohol
  • organic oxygen compound
  • anisole
  • hydrocarbon derivative
  • organooxygen compound