Hmdb loader

Showing information for DMID00076550

Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:06:00 UTC
Update Date2025-03-21 18:29:16 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00076550
Frequency38.5
Structure
Chemical FormulaC21H26O15
Molecular Mass518.1272
SMILESO=c1c(OC2OC(COC3OC(CO)C(O)C(O)C3O)C(O)C(O)C2O)coc2cc(O)cc(O)c12
InChI KeyGZFKZPPDHPIXPU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classbenzopyrans
Subclass 1-benzopyrans
Direct Parent chromones
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • acetals
  • benzenoids
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • monosaccharides
  • organic oxides
  • oxacyclic compounds
  • oxanes
  • primary alcohols
  • pyranones and derivatives
  • secondary alcohols
  • vinylogous acids
    • Substituents
  • 1-hydroxy-2-unsubstituted benzenoid
  • monosaccharide
  • saccharide
  • organic oxide
  • acetal
  • chromone
  • aromatic heteropolycyclic compound
  • pyranone
  • oxane
  • primary alcohol
  • alcohol
  • heteroaromatic compound
  • 1-hydroxy-4-unsubstituted benzenoid
  • oxacycle
  • vinylogous acid
  • organic oxygen compound
  • pyran
  • secondary alcohol
  • hydrocarbon derivative
  • benzenoid
  • organooxygen compound