Hmdb loader

Showing information for DMID02150417

Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:37:41 UTC
Update Date2025-03-25 00:45:38 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02150417
Frequency0.5
Structure
Chemical FormulaC17H16O6
Molecular Mass316.0947
SMILESOc1ccc2c(c1)OCC1OC(c3ccc(O)c(O)c3)C(O)C21
InChI KeyBMKXLFDQUBSARO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classbenzopyrans
Subclass 1-benzopyrans
Direct Parent 1-benzopyrans
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • alkyl aryl ethers
  • benzene and substituted derivatives
  • dialkyl ethers
  • furans
  • furopyrans
  • hydrocarbon derivatives
  • monosaccharides
  • oxacyclic compounds
  • pyrans
  • secondary alcohols
  • tetrahydrofurans
    • Substituents
  • furan
  • monocyclic benzene moiety
  • ether
  • 1-benzopyran
  • 1-hydroxy-2-unsubstituted benzenoid
  • monosaccharide
  • alkyl aryl ether
  • dialkyl ether
  • saccharide
  • aromatic heteropolycyclic compound
  • alcohol
  • tetrahydrofuran
  • furopyran
  • 1-hydroxy-4-unsubstituted benzenoid
  • oxacycle
  • organic oxygen compound
  • pyran
  • secondary alcohol
  • phenol
  • hydrocarbon derivative
  • benzenoid
  • organooxygen compound