Structure Information
Structure

Compound Identification

SMILES

BrC1=C(Br)C2=C(C3=CC=C(N3)C(=C3N=C([C@H]4[C@@H]3C4(C#N)C#N)C(=C3NC(C=C3)=C(C1=N2)C1=CC=CC=C1)C1=CC=CC=C1)C1=CC=CC=C1)C1=CC=CC=C1

InChIKey

InChIKey=PCUYZHAJBFWEKC-LQDDJWCHSA-N

Formula

C47H28Br2N6

Mass

836.591

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Tetrapyrroles and derivatives

Subclass

Chlorins

Intermediate Tree Nodes

Not available

Direct Parent

Chlorins

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Chlorin - Linear 1,7-diphenylheptane skeleton - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Substituted pyrrole - Benzenoid - Pyrrole - Heteroaromatic compound - Nitrile - Carbonitrile - Azacycle - Organonitrogen compound - Organobromide - Organohalogen compound - Cyanide - Organic nitrogen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as chlorins. These are large heterocyclic aromatic ring systems consisting, at the core, of three pyrroles and one pyrroline coupled through four methine linkages.

External Descriptors

Not available

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