Hmdb loader

Showing information for DMID02222074

Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:08:57 UTC
Update Date2025-03-25 00:57:00 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02222074
Frequency0.5
Structure
Chemical FormulaC21H18O2
Molecular Mass302.1307
SMILESc1ccc(C2OCC3C(c4ccc5ccccc5c4)OC23)cc1
InChI KeyUNONKSPAPBXRTF-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classnaphthalenes
Subclass naphthalenes
Direct Parent naphthalenes
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1,4-dioxepanes
  • benzene and substituted derivatives
  • dialkyl ethers
  • hydrocarbon derivatives
  • oxacyclic compounds
  • oxetanes
  • tetrahydrofurans
    • Substituents
  • monocyclic benzene moiety
  • ether
  • tetrahydrofuran
  • 1,4-dioxepane
  • dioxepane
  • dialkyl ether
  • oxacycle
  • naphthalene
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • oxetane
  • hydrocarbon derivative
  • organoheterocyclic compound
  • organooxygen compound