Structure Information
Structure

Compound Identification

SMILES

COCCOC1=NC2=C(N=C(Br)N2[C@@H]2CCC[C@H]2OCP(O)(O)=O)C(N)=N1

InChIKey

InChIKey=MXOWQCVDWQUDHF-RKDXNWHRSA-N

Formula

C14H21BrN5O6P

Mass

466.229

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Nucleosides, nucleotides, and analogues

Class

Nucleoside and nucleotide analogues

Subclass

Phosphonated cyclopentyl nucleosides

Intermediate Tree Nodes

1,2-substituted phosphonated cyclopentyl nucleosides

Direct Parent

1,2-substituted phosphonated cyclopentyl purine nucleosides

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

1,2-substituted phosphonated cyclopentyl purine nucleoside - 6-aminopurine - Purine - Imidazopyrimidine - Alkyl aryl ether - Aminopyrimidine - Aryl bromide - Aryl halide - Imidolactam - Pyrimidine - N-substituted imidazole - Heteroaromatic compound - Azole - Imidazole - Organophosphonic acid - Organophosphonic acid derivative - Azacycle - Organoheterocyclic compound - Dialkyl ether - Ether - Organophosphorus compound - Primary amine - Organic oxide - Amine - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organohalogen compound - Organonitrogen compound - Organobromide - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 1,2-substituted phosphonated cyclopentyl purine nucleosides. These are nucleoside analogues with a structure that consists of a cyclobutane that is substituted a the 1-position with a phosphonate group, and at the 2-position with either a purine base.

External Descriptors

Not available

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