Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:20:45 UTC
Update Date2025-03-25 01:01:22 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02248798
Frequency0.5
Structure
Chemical FormulaC15H14O4
Molecular Mass258.0892
SMILESCOc1ccc(C2(O)COc3ccccc3O2)cc1
InChI KeyRNVAWQNJPHAXMR-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classbenzodioxanes
Subclass phenylbenzodioxanes
Direct Parent phenylbenzo-1,4-dioxanes
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • alkyl aryl ethers
  • anisoles
  • benzo-1,4-dioxanes
  • hemiacetals
  • hydrocarbon derivatives
  • methoxybenzenes
  • oxacyclic compounds
  • para dioxins
  • phenoxy compounds
  • Substituents
  • 2-phenylbenzo-1,4-dioxane
  • benzo-1,4-dioxane
  • phenol ether
  • monocyclic benzene moiety
  • ether
  • alkyl aryl ether
  • methoxybenzene
  • oxacycle
  • organic oxygen compound
  • para-dioxin
  • aromatic heteropolycyclic compound
  • anisole
  • hemiacetal
  • hydrocarbon derivative
  • benzenoid
  • phenoxy compound
  • organooxygen compound