Structure Information
Structure

Compound Identification

SMILES

NC1=NC2=C(N=CN2C[C@@]2(COC(=O)C3=CC=CC=C3)C[C@@H]2COC(=O)C2=CC=CC=C2)C(Cl)=N1

InChIKey

InChIKey=LYTWTLRUVNPZQW-IQGLISFBSA-N

Formula

C25H22ClN5O4

Mass

491.93

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Nucleosides, nucleotides, and analogues

Class

Nucleoside and nucleotide analogues

Subclass

Cyclopropyl nucleosides

Intermediate Tree Nodes

Not available

Direct Parent

Cyclopropyl purine nucleosides

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Cyclopropyl purine nucleoside - Benzoate ester - Benzoic acid or derivatives - Imidazopyrimidine - Purine - Benzoyl - Aminopyrimidine - Halopyrimidine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - N-substituted imidazole - Pyrimidine - Benzenoid - Azole - Imidazole - Heteroaromatic compound - Amino acid or derivatives - Carboxylic acid ester - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Organochloride - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Primary amine - Organohalogen compound - Amine - Aromatic heteropolycyclic compound

Description

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

External Descriptors

Not available

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