Compound Identification
SMILES
CCCCC1=NC(Cl)=C(N1CC1=CC2=C(OC(=C2Br)C2=CC=CC=C2C(O)=O)C=C1)C(=O)NCC(=O)OCC
InChIKey
InChIKey=DBRPSGSXFDVVOM-UHFFFAOYSA-N
Formula
C28H27BrClN3O6
Mass
616.89
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 Alpha amino acid esters N-acyl-alpha amino acids and derivatives 1,2,4,5-tetrasubstituted imidazoles Benzoic acids 2-heteroaryl carboxamides Benzoyl derivatives Imidazolyl carboxylic acids and derivatives Carbonylimidazoles Aryl bromides Aryl chlorides N-substituted imidazoles Vinylogous halides Furans Heteroaromatic compounds Carboxylic acid esters Secondary carboxylic acid amides Monocarboxylic acids and derivatives Azacyclic compounds Carboxylic acids Oxacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organobromides Organochlorides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-arylbenzofuran flavonoid - 2-phenylbenzofuran - Phenylbenzofuran - Alpha-amino acid ester - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - 1,2,4,5-tetrasubstituted imidazole - Benzofuran - Benzoic acid or derivatives - Benzoic acid - 2-heteroaryl carboxamide - Benzoyl - Imidazolyl carboxylic acid derivative - Imidazole-4-carbonyl group - Benzenoid - Aryl bromide - Aryl chloride - Aryl halide - Monocyclic benzene moiety - N-substituted imidazole - Vinylogous halide - Heteroaromatic compound - Azole - Furan - Imidazole - Carboxylic acid ester - Carboxamide group - Secondary carboxylic acid amide - Carboxylic acid - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Oxacycle - Azacycle - Organoheterocyclic compound - Organic oxide - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Organochloride - Carbonyl group - 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