Structure Information
Structure

Compound Identification

SMILES

NC1=NC=NC2=C1N=C(Br)N2[C@@H]1O[C@H](COP(O)(=O)OP(O)(=O)OC[C@H]2O[C@H]([C@H](O)[C@@H]2O)[N+]2=CC=CC(=C2)C(O)=O)[C@@H](O)[C@H]1OP(O)(O)=O

InChIKey

InChIKey=KKXRQTDNDVLJER-LIOZNNDLSA-O

Formula

C21H27BrN6O18P3

Mass

824.296

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Nucleosides, nucleotides, and analogues

Class

(5'->5')-dinucleotides

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

(5'->5')-dinucleotides

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

(5'->5')-dinucleotide - Purine nucleotide sugar - Purine ribonucleoside diphosphate - Purine ribonucleoside bisphosphate - Purine ribonucleoside 2',5'-bisphosphate - Nicotinic-acid-nucleotide - Pyridine nucleotide - Pentose-5-phosphate - Pentose phosphate - N-glycosyl compound - Glycosyl compound - Monosaccharide phosphate - 6-aminopurine - Organic pyrophosphate - Pyridine carboxylic acid or derivatives - Imidazopyrimidine - Purine - Pyridine carboxylic acid - Monoalkyl phosphate - Aminopyrimidine - Aryl bromide - Aryl halide - Monosaccharide - N-substituted imidazole - Organic phosphoric acid derivative - Phosphoric acid ester - Imidolactam - Alkyl phosphate - Pyrimidine - Pyridinium - Pyridine - Oxolane - Azole - Vinylogous amide - Imidazole - Heteroaromatic compound - Secondary alcohol - 1,2-diol - Amino acid or derivatives - Amino acid - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Carboxylic acid - Oxacycle - Organic oxide - Organonitrogen compound - Organic nitrogen compound - Organooxygen compound - Organic oxygen compound - Primary amine - Organohalogen compound - Organobromide - Hydrocarbon derivative - Amine - Alcohol - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as (5'->5')-dinucleotides. These are dinucleotides where the two bases are connected via a (5'->5')-phosphodiester linkage.

External Descriptors

Not available

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