Structure Information
Structure

Compound Identification

SMILES

CN(C)C(=O)COC1=C2CC3=CC(=CC(CC4=C(OCC(=O)N(C)C)C(CC5=C(OCC(=O)N(C)C)C(CC1=CC(=C2)S(O)(=O)=O)=CC(=C5)S(O)(=O)=O)=CC(=C4)S(O)(=O)=O)=C3OCC(=O)N(C)C)S(O)(=O)=O

InChIKey

InChIKey=ABXYLTURIBTGHV-UHFFFAOYSA-N

Formula

C44H52N4O20S4

Mass

1085.15

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic acids and derivatives

Class

Organic sulfonic acids and derivatives

Subclass

Organosulfonic acids and derivatives

Intermediate Tree Nodes

Arylsulfonic acids and derivatives - Arylsufonic acids

Direct Parent

1-sulfo,2-unsubstituted aromatic compounds

Alternative Parents

Molecular Framework

Aromatic homopolycyclic compounds

Substituents

1-sulfo,2-unsubstituted aromatic compound - Phenol ether - Alkyl aryl ether - Benzenoid - Organosulfonic acid - Tertiary carboxylic acid amide - Sulfonyl - Carboxamide group - Carboxylic acid derivative - Ether - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic oxide - Carbonyl group - Hydrocarbon derivative - Organic nitrogen compound - Aromatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as 1-sulfo,2-unsubstituted aromatic compounds. These are an arylsulfonic acid carrying the sulfonic acid group at the 1-position, and no substitute at the 2-position of the aromatic ring.

External Descriptors

Not available

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