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Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:51:01 UTC
Update Date2025-03-21 18:02:54 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00040976
Frequency84.1
Structure
Chemical FormulaC18H26O4
Molecular Mass306.1831
SMILESCC=Cc1ccc(OC2OC(C(O)O)C(C)C(C)C2C)cc1
InChI KeyCCNFDOGPGJSCHC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenol ethers
Subclass phenol ethers
Direct Parent phenol ethers
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • acetals
  • carbonyl hydrates
  • hydrocarbon derivatives
  • organooxygen compounds
  • oxacyclic compounds
  • oxanes
  • phenoxy compounds
    • Substituents
  • phenol ether
  • monocyclic benzene moiety
  • carbonyl hydrate
  • aromatic heteromonocyclic compound
  • oxacycle
  • organic oxygen compound
  • acetal
  • hydrocarbon derivative
  • phenoxy compound
  • oxane
  • organoheterocyclic compound
  • organooxygen compound