Structure Information
Structure

Compound Identification

SMILES

COC(=O)CCC1=C2NC(C=C3N=C(C=C4NC(=CC5=NC(=C2)C(CCC(=O)OC)=C5C)C(C(C)Br)=C4C)C2=CC=C([C@@H](C(=O)OC)[C@@]32C)C(=O)OC)=C1C

InChIKey

InChIKey=MHPMQAVEOIBWPU-YGQOTDERSA-N

Formula

C42H45BrN4O8

Mass

813.746

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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 - Tetracarboxylic acid or derivatives - Isoindole or derivatives - Fatty acid ester - Substituted pyrrole - Fatty acyl - Heteroaromatic compound - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Methyl ester - Pyrrole - Carboxylic acid ester - Azacycle - Carboxylic acid derivative - Alkyl halide - Organonitrogen compound - Organobromide - Organohalogen compound - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Alkyl bromide - Carbonyl group - 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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