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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:12:29 UTC
Update Date2025-03-25 00:58:18 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02229841
Frequency0.5
Structure
Chemical FormulaC16H20O2
Molecular Mass244.1463
SMILESCCCC=CCC(C=O)=Cc1ccc(OC)cc1
InChI KeyGBGXMBPSNPIWDN-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassphenylpropanoids and polyketides
Classcinnamaldehydes
Subclass cinnamaldehydes
Direct Parent cinnamaldehydes
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • aldehydes
  • alkyl aryl ethers
  • anisoles
  • hydrocarbon derivatives
  • methoxybenzenes
  • organic oxides
  • phenoxy compounds
    • Substituents
  • phenol ether
  • monocyclic benzene moiety
  • cinnamaldehyde
  • carbonyl group
  • ether
  • aldehyde
  • alkyl aryl ether
  • methoxybenzene
  • aromatic homomonocyclic compound
  • organic oxide
  • organic oxygen compound
  • anisole
  • hydrocarbon derivative
  • benzenoid
  • phenoxy compound
  • organooxygen compound