Compound Identification
SMILES
CCC1=NC2=C(C)C(Br)=C(C)N=C2N1CC1=CC2=C(OC(=C2Br)C2=C(C(=O)OC)C(F)=CC=C2)C=C1
InChIKey
InChIKey=MIQFHNKEWCNEHZ-UHFFFAOYSA-N
Formula
C27H22Br2FN3O3
Mass
615.297
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 2-halobenzoic acids and derivatives Benzoic acid esters Imidazopyridines Benzoyl derivatives Fluorobenzenes Methylpyridines Aryl bromides Aryl fluorides N-substituted imidazoles Vinylogous halides Furans Heteroaromatic compounds Methyl esters Oxacyclic compounds Azacyclic compounds Monocarboxylic acids and derivatives Organopnictogen compounds Organobromides Organofluorides Organonitrogen compounds Hydrocarbon derivatives Organic oxides Organooxygen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-arylbenzofuran flavonoid - 2-phenylbenzofuran - Phenylbenzofuran - Benzoate ester - 2-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzofuran - Benzoic acid or derivatives - Imidazopyridine - Benzoyl - Methylpyridine - Fluorobenzene - Halobenzene - Aryl bromide - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - N-substituted imidazole - Pyridine - Benzenoid - Methyl ester - Vinylogous halide - Azole - Heteroaromatic compound - Furan - Imidazole - Carboxylic acid ester - Organoheterocyclic compound - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Azacycle - Oxacycle - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Organobromide - Organohalogen compound - Organofluoride - 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