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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:37:32 UTC
Update Date2025-03-25 00:45:35 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02150043
Frequency0.5
Structure
Chemical FormulaC20H24O2
Molecular Mass296.1776
SMILESCc1cc(C)c2c(c1C)OC(C)(Cc1cccc(O)c1)CC2
InChI KeyRLSIBZIHZJJVCZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classbenzopyrans
Subclass 1-benzopyrans
Direct Parent 1-benzopyrans
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • alkyl aryl ethers
  • benzene and substituted derivatives
  • hydrocarbon derivatives
  • oxacyclic compounds
    • Substituents
  • monocyclic benzene moiety
  • ether
  • 1-benzopyran
  • 1-hydroxy-2-unsubstituted benzenoid
  • 1-hydroxy-4-unsubstituted benzenoid
  • alkyl aryl ether
  • oxacycle
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • phenol
  • hydrocarbon derivative
  • benzenoid
  • organooxygen compound