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Structure Information
Structure

Compound Identification

SMILES

CC(=O)CCC(=O)O[C@H]1C[C@@H](O[C@@H]1COP(=O)(O[C@H]1C[C@@H](O[C@@H]1COP(=O)(O[C@H]1C[C@@H](O[C@@H]1COP(=O)(O[C@H]1C[C@@H](O[C@@H]1CO)N1C=C(C)C(=O)NC1=O)SC1=CC=C(Cl)C=C1)N1C=NC2=C1NC(N)=NC2=O)SCCC#N)N1C=NC2=C1N=CN=C2N)SC1=CC=C(Cl)C=C1)N1C=CC(N)=NC1=O

InChIKey

InChIKey=BRNARZXOZHASLC-PPILHYLUSA-N

Formula

C59H65Cl2N16O21P3S3

Mass

1594.26

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Nucleosides, nucleotides, and analogues

Class

Nucleoside and nucleotide analogues

Subclass

Phosphorothioate oligonucleotides

Intermediate Tree Nodes

Not available

Direct Parent

Phosphorothioate oligonucleotides

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Phosphorothioate oligonucleotide - Pyrimidine 2'-deoxyribonucleoside - Pyrimidine nucleoside - 6-aminopurine - 6-oxopurine - Hypoxanthine - Imidazopyrimidine - Purine - Gamma-keto acid - Aminopyrimidine - Halobenzene - Pyrimidone - Fatty acid ester - Chlorobenzene - Monocyclic benzene moiety - N-substituted imidazole - Pyrimidine - Aryl halide - Keto acid - Hydropyrimidine - Benzenoid - Fatty acyl - Imidolactam - Aryl chloride - Imidazole - Azole - Heteroaromatic compound - Oxolane - Vinylogous amide - Amino acid or derivatives - Carboxylic acid ester - Urea - Ketone - Lactam - Nitrile - Carbonitrile - Monocarboxylic acid or derivatives - Oxacycle - Azacycle - Organothiophosphorus compound - Carboxylic acid derivative - Organoheterocyclic compound - Sulfenyl compound - Organohalogen compound - Alcohol - Primary amine - Organic oxygen compound - Primary alcohol - Carbonyl group - Organosulfur compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Cyanide - Organonitrogen compound - Organochloride - Amine - Organic nitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as phosphorothioate oligonucleotides. These are oligonucleotides in which one of the non-bridging oxygens in each phosphodiester linkage has been replaced by sulfur.

External Descriptors

Not available

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