Structure Information
Structure

Compound Identification

SMILES

[Na+].[Na+].CC(C)C1=CC=CC(C(C)C)=C1N1C(=O)C2=CC(OC3=CC=C(C=C3)S([O-])(=O)=O)=C3C4=CC=CC5=C(C=CC(C6=C(OC7=CC=C(C=C7)S([O-])(=O)=O)C=C(C1=O)C2=C36)=C45)C#CCCCCN=[N+]=[N-]

InChIKey

InChIKey=IFXHPYPMABGECL-UHFFFAOYSA-L

Formula

C52H40N4Na2O10S2

Mass

991.01

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Phenanthrenes and derivatives

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Phenanthrenes and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Anthracene - Phenanthrene - Diaryl ether - Isoquinolone - Isoquinoline - Benzenesulfonate - Arylsulfonic acid or derivatives - Cumene - Benzenesulfonyl group - Phenylpropane - 1-sulfo,2-unsubstituted aromatic compound - Phenoxy compound - Phenol ether - Pyridinone - Pyridine - Monocyclic benzene moiety - Sulfonyl - Organosulfonic acid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Heteroaromatic compound - Azo compound - Azo imide - Lactam - Organoheterocyclic compound - Organic alkali metal salt - Ether - Azacycle - Organic oxygen compound - Organic salt - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Organic sodium salt - Organic nitrogen compound - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as phenanthrenes and derivatives. These are polycyclic compounds containing a phenanthrene moiety, which is a tricyclic aromatic compound with three non-linearly fused benzene.

External Descriptors

Not available

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