Structure Information
Structure

Compound Identification

SMILES

CSP1(=O)OCC2O[C@@H]([C@@H](O)C2O1)N1C(SCC(=O)C(=O)CBr)=NC2=C1N=CN=C2N

InChIKey

InChIKey=AUTPHGDLORCMDC-YNDQRPDGSA-N

Formula

C15H17BrN5O7PS2

Mass

554.33

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Nucleosides, nucleotides, and analogues

Class

Nucleoside and nucleotide analogues

Subclass

3',5'-cyclic purine nucleoside phosphorothioates

Intermediate Tree Nodes

Not available

Direct Parent

3',5'-cyclic purine nucleoside phosphorothioates

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

3',5'-cyclic purine nucleoside phosphorothioate - Glycosyl compound - N-glycosyl compound - 6-aminopurine - Imidazopyrimidine - Purine - Aryl thioether - Aminopyrimidine - Alkylarylthioether - Alpha-diketone - Monosaccharide - N-substituted imidazole - Pyrimidine - Imidolactam - Heteroaromatic compound - Oxolane - Alpha-haloketone - Azole - Imidazole - Secondary alcohol - Ketone - Thioether - Azacycle - Organoheterocyclic compound - Organothiophosphorus compound - Oxacycle - Sulfenyl compound - Alkyl halide - Alcohol - Alkyl bromide - Hydrocarbon derivative - Organohalogen compound - Organic oxide - Organic oxygen compound - Carbonyl group - Organobromide - Organic nitrogen compound - Amine - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Primary amine - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 3',5'-cyclic purine nucleoside phosphorothioates. These are 3',5'-cyclic purine nucleoside phosphate analogues, where a phosphate oxygen has been exchanged for sulphur generating a chiral phosphorothioate. In 3',5'-cyclic nucleoside phosphorothioate, the oxygen atoms at the 3'- and 5'-positions of the ribose are part of the phosphorothioate group.

External Descriptors

Not available

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