Compound Identification
SMILES
CCOC(=O)C1=C(Cl)N=C(CC)N1CC1=CC2=C(OC(=C2Br)C2=CC=CC=C2NC(=O)OC(C)(C)C)C=C1
InChIKey
InChIKey=NSYGAPGYEZHWTE-UHFFFAOYSA-N
Formula
C28H29BrClN3O5
Mass
602.91
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 Phenylcarbamic acid esters 1,2,4,5-tetrasubstituted imidazoles Carbonylimidazoles Aryl bromides Aryl chlorides N-substituted imidazoles Vinylogous halides Carbamate esters Furans Heteroaromatic compounds Carboxylic acid esters Oxacyclic compounds Azacyclic compounds Organobromides Carbonyl compounds Organonitrogen compounds Organochlorides Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-arylbenzofuran flavonoid - 2-phenylbenzofuran - Phenylbenzofuran - Phenylcarbamic acid ester - 1,2,4,5-tetrasubstituted imidazole - Benzofuran - Imidazole-4-carbonyl group - Aryl bromide - Aryl chloride - Aryl halide - Monocyclic benzene moiety - N-substituted imidazole - Benzenoid - Heteroaromatic compound - Azole - Furan - Imidazole - Vinylogous halide - Carbamic acid ester - Carboxylic acid ester - Carboxylic acid derivative - Organoheterocyclic compound - Azacycle - Oxacycle - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organic oxygen compound - Organohalogen compound - Organobromide - Organochloride - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - 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