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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:49:34 UTC
Update Date2025-03-25 00:49:55 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02177531
Frequency0.5
Structure
Chemical FormulaC17H18O6
Molecular Mass318.1103
SMILESCOc1cc(C2(c3ccc(O)cc3)OCC(CO)O2)ccc1O
InChI KeyYEFZOCMMSQJWEW-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass diphenylmethanes
Direct Parent diphenylmethanes
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 1,3-dioxolanes
  • 1-hydroxy-2-unsubstituted benzenoids
  • alkyl aryl ethers
  • anisoles
  • hydrocarbon derivatives
  • ketals
  • methoxybenzenes
  • methoxyphenols
  • oxacyclic compounds
  • phenoxy compounds
  • primary alcohols
  • Substituents
  • alcohol
  • diphenylmethane
  • phenol ether
  • meta-dioxolane
  • ether
  • aromatic heteromonocyclic compound
  • 1-hydroxy-2-unsubstituted benzenoid
  • methoxyphenol
  • alkyl aryl ether
  • methoxybenzene
  • oxacycle
  • organic oxygen compound
  • acetal
  • anisole
  • ketal
  • phenol
  • hydrocarbon derivative
  • phenoxy compound
  • primary alcohol
  • organoheterocyclic compound
  • organooxygen compound