Compound Identification
SMILES
CCCCC1=NC(CC2=CC=CC=C2C(O)=O)C(=O)N1CC1=CC2=C(OC(=C2Br)C2=CC=CC=C2C2=NNN=N2)C=C1
InChIKey
InChIKey=QSHFFWGBGPJLAU-UHFFFAOYSA-N
Formula
C31H27BrN6O4
Mass
627.499
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 Benzoic acids Benzoyl derivatives Imidazolyl carboxylic acids and derivatives Aryl bromides Imidazolinones Furans Heteroaromatic compounds Tertiary amines Amino acids Carboxylic acids Carboximidamides Carboxamidines Azacyclic compounds Oxacyclic compounds Propargyl-type 1,3-dipolar organic compounds Carbonyl compounds Organic oxides Organobromides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-arylbenzofuran flavonoid - 2-phenylbenzofuran - Phenylbenzofuran - Phenyltetrazole - Alpha-amino acid or derivatives - Benzoic acid - Benzoic acid or derivatives - Benzofuran - Imidazolyl carboxylic acid derivative - Benzoyl - Imidazolinone - Aryl bromide - Aryl halide - Benzenoid - Monocyclic benzene moiety - Heteroaromatic compound - Tetrazole - 2-imidazoline - Azole - Furan - Tertiary amine - Amino acid or derivatives - Amino acid - Amidine - Oxacycle - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Carboxylic acid amidine - Carboxylic acid derivative - Carboxylic acid - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Amine - Organonitrogen compound - Organobromide - Organohalogen 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