Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:16:33 UTC
Update Date2025-03-21 18:34:40 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00101886
Frequency26.8
Structure
Chemical FormulaC19H20O10
Molecular Mass408.1056
SMILESOCC1OC(Oc2cc3c(cc2-c2ccc(O)c(O)c2)OCO3)C(O)C(O)C1O
InChI KeyJBUTXYMXSDYBAU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classbenzodioxoles
Subclass benzodioxoles
Direct Parent benzodioxoles
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • acetals
  • benzene and substituted derivatives
  • hydrocarbon derivatives
  • monosaccharides
  • oxacyclic compounds
  • oxanes
  • phenol ethers
  • primary alcohols
  • secondary alcohols
  • Substituents
  • alcohol
  • phenol ether
  • monocyclic benzene moiety
  • 1-hydroxy-2-unsubstituted benzenoid
  • monosaccharide
  • 1-hydroxy-4-unsubstituted benzenoid
  • oxacycle
  • saccharide
  • organic oxygen compound
  • acetal
  • aromatic heteropolycyclic compound
  • secondary alcohol
  • phenol
  • hydrocarbon derivative
  • benzenoid
  • oxane
  • primary alcohol
  • organooxygen compound
  • benzodioxole