Compound Identification
SMILES
CCCCC1=NC(Cl)=C(N1CC1=CC2=C(OC(=C2Br)C2=CC=CC=C2C(=O)OC)C=C1)C(O)=O
InChIKey
InChIKey=BMOCFOWJXDTSDH-UHFFFAOYSA-N
Formula
C25H22BrClN2O5
Mass
545.81
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
2-phenylbenzofurans Benzoic acid esters 1,2,4,5-tetrasubstituted imidazoles Benzoyl derivatives Carbonylimidazoles Aryl bromides Aryl chlorides Dicarboxylic acids and derivatives N-substituted imidazoles Vinylogous halides Furans Heteroaromatic compounds Methyl esters Carboxylic acids Azacyclic compounds Oxacyclic compounds Organic oxides Organobromides Organochlorides Organonitrogen compounds Organopnictogen compounds Hydrocarbon derivatives Organooxygen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-arylbenzofuran flavonoid - 2-phenylbenzofuran - Phenylbenzofuran - Benzoate ester - 1,2,4,5-tetrasubstituted imidazole - Benzofuran - Benzoic acid or derivatives - Benzoyl - Imidazole-4-carbonyl group - Aryl bromide - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - N-substituted imidazole - Benzenoid - Vinylogous halide - Azole - Methyl ester - Imidazole - Furan - Heteroaromatic compound - Carboxylic acid ester - Organoheterocyclic compound - Azacycle - Carboxylic acid - Carboxylic acid derivative - Oxacycle - Organochloride - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Organohalogen compound - Organobromide - 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