Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:51:00 UTC
Update Date2025-03-25 00:50:25 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02180813
Frequency0.5
Structure
Chemical FormulaC20H16O4
Molecular Mass320.1049
SMILESOc1cccc(C2c3ccc(O)cc3COc3cc(O)ccc32)c1
InChI KeyUSISYMFVDWXUIP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classbenzoxepines
Subclass dibenzoxepines
Direct Parent dibenzoxepines
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-hydroxy-2-unsubstituted benzenoid
  • 1-hydroxy-4-unsubstituted benzenoid
  • alkyl aryl ether
  • oxacycle
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • phenol
  • hydrocarbon derivative
  • benzenoid
  • dibenzoxepine
  • organooxygen compound