Compound Identification
SMILES
[Na+].[Na+].OC1=C(Br)C=C(C=C1)C1=CC2=CC(\C=C(/OS([O-])(=O)=O)\C(\OS([O-])(=O)=O)=C\C3=CC(Br)=C4OC(=CC4=C3)C3=CC(Br)=C(O)C=C3)=CC(Br)=C2O1
InChIKey
InChIKey=FXPJDFSMGKKULQ-WLADAGMQSA-L
Formula
C32H16Br4Na2O12S2
Mass
1022.18
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
Lignans, neolignans and related compounds 2-phenylbenzofurans O-bromophenols 1-hydroxy-2-unsubstituted benzenoids Bromobenzenes Sulfuric acid monoesters Aryl bromides Furans Heteroaromatic compounds Oxacyclic compounds Organic metal halides Organic oxides Hydrocarbon derivatives Organooxygen compounds Organic sodium salts Organobromides Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-arylbenzofuran flavonoid - Norlignan skeleton - 2-phenylbenzofuran - Phenylbenzofuran - Benzofuran - 2-halophenol - 2-bromophenol - 1-hydroxy-2-unsubstituted benzenoid - Bromobenzene - Halobenzene - Phenol - Benzenoid - Sulfuric acid ester - Sulfate-ester - Sulfuric acid monoester - Aryl halide - Monocyclic benzene moiety - Aryl bromide - Heteroaromatic compound - Organic sulfuric acid or derivatives - Furan - Organic alkali metal salt - Oxacycle - Organoheterocyclic compound - Organic metal halide - Organic sodium salt - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Organohalogen compound - Organic oxygen compound - Organobromide - Organic salt - 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