Compound Identification
SMILES
[NH4+].[NH4+].COC1=CC(=CC2=C1C=C(O2)C1=NC=C(O1)C([O-])=O)N1CCOCCOCCN(CCOCC1)C1=C(OC)C2=C(OC(=C2)C2=NC=C(O2)C([O-])=O)C=C1
InChIKey
InChIKey=ONAYWOXQYXMZHY-UHFFFAOYSA-N
Formula
C36H42N6O13
Mass
766.761
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzofurans
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzofurans
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzofurans
Alternative Parents
Methoxyanilines Anisoles Dialkylarylamines 2,5-disubstituted oxazoles Alkyl aryl ethers Quaternary ammonium salts Heteroaromatic compounds Furans Amino acids Carboxylic acid salts Oxacyclic compounds Azacyclic compounds Carboxylic acids Dialkyl ethers Organic zwitterions Hydrocarbon derivatives Organic salts Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzofuran - Methoxyaniline - Anisole - Phenol ether - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Alkyl aryl ether - 2,5-disubstituted 1,3-oxazole - Benzenoid - Furan - Oxazole - Quaternary ammonium salt - Azole - Heteroaromatic compound - Tertiary amine - Amino acid - Carboxylic acid salt - Amino acid or derivatives - Carboxylic acid - Ether - Oxacycle - Dialkyl ether - Carboxylic acid derivative - Azacycle - Organic oxide - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Amine - Organic zwitterion - Organic salt - Hydrocarbon derivative - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzofurans. These are organic compounds containing a benzene ring fused to a furan. Furan is a five-membered aromatic ring with four carbon atoms and one oxygen atom.
External Descriptors
Not available