Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:51:25 UTC
Update Date2025-03-21 18:03:02 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00041902
Frequency81.8
Structure
Chemical FormulaC20H20O6
Molecular Mass356.126
SMILESCOc1ccc(C2COC3C(c4ccc5c(c4)OCO5)OCC23)cc1O
InChI KeyRBNBWBJNCAONEQ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenols
Subclass methoxyphenols
Direct Parent methoxyphenols
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • acetals
  • alkyl aryl ethers
  • anisoles
  • benzodioxoles
  • dialkyl ethers
  • furofurans
  • hydrocarbon derivatives
  • methoxybenzenes
  • oxacyclic compounds
  • phenoxy compounds
  • tetrahydrofurans
  • Substituents
  • phenol ether
  • monocyclic benzene moiety
  • ether
  • tetrahydrofuran
  • 1-hydroxy-2-unsubstituted benzenoid
  • methoxyphenol
  • 1-hydroxy-4-unsubstituted benzenoid
  • alkyl aryl ether
  • methoxybenzene
  • dialkyl ether
  • oxacycle
  • organic oxygen compound
  • acetal
  • aromatic heteropolycyclic compound
  • furofuran
  • anisole
  • hydrocarbon derivative
  • phenoxy compound
  • organoheterocyclic compound
  • organooxygen compound
  • benzodioxole