Hmdb loader

Showing information for DMID02220239

Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:08:09 UTC
Update Date2025-03-25 00:56:42 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02220239
Frequency0.5
Structure
Chemical FormulaC27H28O17
Molecular Mass624.1326
SMILESCOc1cccc(C2Oc3cc(OC4OC(C(=O)O)C(O)C(O)C4O)cc(OC4OC(C(=O)O)C(O)C(O)C4O)c3C2=O)c1
InChI KeyVRBBADFRLDRLNO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassphenylpropanoids and polyketides
Class2-arylbenzofuran flavonoids
Subclass 2-arylbenzofuran flavonoids
Direct Parent 2-arylbenzofuran flavonoids
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • acetals
  • alkyl aryl ethers
  • anisoles
  • aryl alkyl ketones
  • benzofuranones
  • beta hydroxy acids and derivatives
  • carboxylic acids
  • coumarans
  • dicarboxylic acids and derivatives
  • glucuronic acid derivatives
  • hydrocarbon derivatives
  • methoxybenzenes
  • monosaccharides
  • o-glucuronides
  • organic oxides
  • oxacyclic compounds
  • oxanes
  • phenoxy compounds
  • pyran carboxylic acids
  • secondary alcohols
    • Substituents
  • phenol ether
  • monocyclic benzene moiety
  • carbonyl group
  • ether
  • carboxylic acid
  • aryl alkyl ketone
  • glucuronic acid or derivatives
  • benzofuranone
  • 2-arylbenzofuran flavonoid
  • o-glucuronide
  • monosaccharide
  • alkyl aryl ether
  • carboxylic acid derivative
  • pyran carboxylic acid
  • ketone
  • 1-o-glucuronide
  • beta-hydroxy acid
  • saccharide
  • organic oxide
  • acetal
  • aromatic heteropolycyclic compound
  • oxane
  • organoheterocyclic compound
  • coumaran
  • alcohol
  • pyran carboxylic acid or derivatives
  • benzofuran
  • hydroxy acid
  • methoxybenzene
  • oxacycle
  • organic oxygen compound
  • pyran
  • anisole
  • secondary alcohol
  • dicarboxylic acid or derivatives
  • hydrocarbon derivative
  • benzenoid
  • phenoxy compound
  • organooxygen compound
  • aryl ketone