Compound Identification
SMILES
[Mg++].OC1=C2O[C@@H]([C@@H](C(=O)O[C@@H](CC3=CC(O)=C(O)C=C3)C([O-])=O)C2=C(CCC(=O)O[C@H](CC2=CC(O)=C(O)C=C2)C([O-])=O)C=C1)C1=CC(O)=C(O)C=C1
InChIKey
InChIKey=JLIHYXRQNVBVMR-PQNDNTKISA-L
Formula
C36H30MgO16
Mass
742.925
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
2-arylbenzofuran flavonoids
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
2-arylbenzofuran flavonoids
Alternative Parents
Tetracarboxylic acids and derivatives Phenylpropanoic acids Coumarans Catechols 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids Alkyl aryl ethers Fatty acid esters Benzene and substituted derivatives Carboxylic acid salts Carboxylic acid esters Oxacyclic compounds Carboxylic acids Organic salts Carbonyl compounds Hydrocarbon derivatives Organic oxides Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-arylbenzofuran flavonoid - Tetracarboxylic acid or derivatives - 3-phenylpropanoic-acid - Coumaran - Catechol - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Alkyl aryl ether - Fatty acid ester - Phenol - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Carboxylic acid ester - Carboxylic acid salt - Carboxylic acid derivative - Oxacycle - Carboxylic acid - Organoheterocyclic compound - Ether - Organic oxide - Hydrocarbon derivative - Carbonyl group - Organic oxygen compound - Organic salt - Organooxygen compound - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 2-arylbenzofuran flavonoids. These are phenylpropanoids containing the 2-phenylbenzofuran moiety.
External Descriptors
Not available