Structure Information
Structure

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

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzofurans

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Benzofurans

Alternative Parents

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

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