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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:19:31 UTC
Update Date2025-03-25 01:00:57 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02245990
Frequency0.5
Structure
Chemical FormulaC15H14O2
Molecular Mass226.0994
SMILESCC=C(C=O)c1ccc2cc(OC)ccc2c1
InChI KeyLPJJRBGPJXBWNS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classnaphthalenes
Subclass naphthalenes
Direct Parent naphthalenes
Geometric Descriptor aromatic homopolycyclic compounds
Alternative Parents
  • aldehydes
  • alkyl aryl ethers
  • anisoles
  • hydrocarbon derivatives
  • organic oxides
  • phenylacetaldehydes
    • Substituents
  • phenol ether
  • carbonyl group
  • ether
  • aldehyde
  • aromatic homopolycyclic compound
  • alkyl aryl ether
  • organic oxide
  • naphthalene
  • organic oxygen compound
  • anisole
  • hydrocarbon derivative
  • organooxygen compound
  • phenylacetaldehyde