Structure Information
Structure

Compound Identification

SMILES

NC1=NC=NC2=C1N=CN2[C@H]1OC2COP(=O)(OC2[C@@H]1O)SCC(=O)C(=O)CBr

InChIKey

InChIKey=PQFFLFJVMNXPRI-VLZDQPGWSA-N

Formula

C14H15BrN5O7PS

Mass

508.24

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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 - Purine - Imidazopyrimidine - Aminopyrimidine - N-substituted imidazole - Alpha-diketone - Monosaccharide - Pyrimidine - Imidolactam - Alpha-haloketone - Azole - Imidazole - Heteroaromatic compound - Oxolane - Ketone - Secondary alcohol - Oxacycle - Azacycle - Organoheterocyclic compound - Sulfenyl compound - Organothiophosphorus compound - Organic oxygen compound - Primary amine - Alkyl halide - Alkyl bromide - Alcohol - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Amine - Organosulfur compound - Organohalogen compound - Organobromide - Organonitrogen compound - Organooxygen compound - 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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