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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:49:18 UTC
Update Date2025-03-25 00:49:50 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02176893
Frequency0.5
Structure
Chemical FormulaC14H14O2
Molecular Mass214.0994
SMILESC=CC1=C(C)OC1=Cc1ccc(OC)cc1
InChI KeyZHSWUUDWQVQHIN-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenol ethers
Subclass anisoles
Direct Parent anisoles
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • alkyl aryl ethers
  • hydrocarbon derivatives
  • methoxybenzenes
  • oxacyclic compounds
  • oxetenes
  • phenoxy compounds
    • Substituents
  • monocyclic benzene moiety
  • ether
  • aromatic heteromonocyclic compound
  • alkyl aryl ether
  • methoxybenzene
  • oxacycle
  • organic oxygen compound
  • anisole
  • hydrocarbon derivative
  • oxetene
  • phenoxy compound
  • organoheterocyclic compound
  • organooxygen compound