Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:50:19 UTC
Update Date2025-03-25 00:50:10 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02179240
Frequency0.5
Structure
Chemical FormulaC18H14O6
Molecular Mass326.079
SMILESOc1ccc(C2OC3OC=CC3c3cc4c(cc32)OCO4)cc1O
InChI KeyUEBLLEMDPVAEQJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classbenzopyrans
Subclass 2-benzopyrans
Direct Parent 2-benzopyrans
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • acetals
  • benzene and substituted derivatives
  • benzodioxoles
  • dihydrofurans
  • furans
  • furopyrans
  • hydrocarbon derivatives
  • organooxygen compounds
  • oxacyclic compounds
  • pyrans
  • Substituents
  • furan
  • monocyclic benzene moiety
  • 1-hydroxy-2-unsubstituted benzenoid
  • furopyran
  • 1-hydroxy-4-unsubstituted benzenoid
  • oxacycle
  • organic oxygen compound
  • acetal
  • aromatic heteropolycyclic compound
  • pyran
  • 2-benzopyran
  • phenol
  • hydrocarbon derivative
  • benzenoid
  • organooxygen compound
  • benzodioxole
  • dihydrofuran