Compound Identification
SMILES
CCCCC1=NC2=C(N1CC1=CC3=C(OC(=C3Br)C3=CC=CC=C3C3=NNN=N3)C=C1)C(=O)NCC(=O)N2C
InChIKey
InChIKey=TWMBSWNMOKLUOC-UHFFFAOYSA-N
Formula
C27H25BrN8O3
Mass
589.454
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 Phenyltetrazoles and derivatives Alpha amino acids and derivatives Imidazodiazepines 2-heteroaryl carboxamides 1,4-diazepines N-substituted imidazoles Imidolactams Aryl bromides Benzene and substituted derivatives Vinylogous amides Tertiary carboxylic acid amides Heteroaromatic compounds Furans Secondary carboxylic acid amides Lactams Oxacyclic compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides Organobromides Organonitrogen compounds Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-arylbenzofuran flavonoid - 2-phenylbenzofuran - Phenylbenzofuran - Phenyltetrazole - Alpha-amino acid or derivatives - Imidazodiazepine - Imidazo-para-diazepine - Benzofuran - 2-heteroaryl carboxamide - Para-diazepine - N-substituted imidazole - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Benzenoid - Imidolactam - Azole - Heteroaromatic compound - Tertiary carboxylic acid amide - Tetrazole - Vinylogous amide - Furan - Imidazole - Secondary carboxylic acid amide - Carboxamide group - Lactam - Carboxylic acid derivative - Organoheterocyclic compound - Azacycle - Oxacycle - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organobromide - Organohalogen compound - Organic oxide - 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