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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:14:59 UTC
Update Date2025-03-25 00:59:11 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02235585
Frequency0.5
Structure
Chemical FormulaC17H18O3
Molecular Mass270.1256
SMILESCOc1ccc(C2COCc3cc(OC)ccc32)cc1
InChI KeyLWDFQZCLKDRURM-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classbenzopyrans
Subclass 2-benzopyrans
Direct Parent 2-benzopyrans
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • alkyl aryl ethers
  • anisoles
  • dialkyl ethers
  • hydrocarbon derivatives
  • methoxybenzenes
  • oxacyclic compounds
  • phenoxy compounds
    • Substituents
  • phenol ether
  • monocyclic benzene moiety
  • ether
  • alkyl aryl ether
  • methoxybenzene
  • dialkyl ether
  • oxacycle
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • anisole
  • 2-benzopyran
  • hydrocarbon derivative
  • benzenoid
  • phenoxy compound
  • organooxygen compound