Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:07:40 UTC
Update Date2025-03-25 00:56:32 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02219065
Frequency0.5
Structure
Chemical FormulaC19H18O6
Molecular Mass342.1103
SMILESCOc1ccc(C2OCC3C(c4ccc5c(c4)OCO5)OOC23)cc1
InChI KeyDZEYWIQLTVSQQP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classbenzodioxoles
Subclass benzodioxoles
Direct Parent benzodioxoles
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1,2-dioxolanes
  • acetals
  • alkyl aryl ethers
  • anisoles
  • dialkyl ethers
  • dialkyl peroxides
  • hydrocarbon derivatives
  • methoxybenzenes
  • oxacyclic compounds
  • phenoxy compounds
  • tetrahydrofurans
  • Substituents
  • phenol ether
  • monocyclic benzene moiety
  • ether
  • tetrahydrofuran
  • alkyl aryl ether
  • methoxybenzene
  • dialkyl ether
  • oxacycle
  • organic oxygen compound
  • acetal
  • aromatic heteropolycyclic compound
  • anisole
  • dialkyl peroxide
  • hydrocarbon derivative
  • benzenoid
  • phenoxy compound
  • ortho-dioxolane
  • organooxygen compound
  • benzodioxole