Structure Information
Structure

Compound Identification

SMILES

CC(C)C(=O)NC1=NC2=C(N=CN2[C@@H]2C[C@H](COC(=O)C3=CC=CC=C3)[C@H]2COC(=O)C2=CC=CC=C2)C(Cl)=N1

InChIKey

InChIKey=IXWQSFZJHOSQCK-YPAWHYETSA-N

Formula

C29H28ClN5O5

Mass

562.02

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Nucleosides, nucleotides, and analogues

Class

Nucleoside and nucleotide analogues

Subclass

Cyclobutyl nucleosides

Intermediate Tree Nodes

Not available

Direct Parent

Cyclobutyl nucleosides

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Cyclobutyl purine nucleoside - Cyclobutyl nucleoside - Benzoate ester - Benzoic acid or derivatives - Purine - Imidazopyrimidine - N-arylamide - Benzoyl - Halopyrimidine - Aryl halide - Benzenoid - Aryl chloride - Pyrimidine - N-substituted imidazole - Monocyclic benzene moiety - Imidazole - Azole - Heteroaromatic compound - Carboxylic acid ester - Secondary carboxylic acid amide - Carboxamide group - Organoheterocyclic compound - Carboxylic acid derivative - Azacycle - Organic nitrogen compound - Organohalogen compound - Carbonyl group - Organochloride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as cyclobutyl nucleosides. These are nucleoside analogues with a structure that consists of a cyclobutane that is substituted a the 1-position with a hydroxyl group and at the 3- position with either a purine or pyrimidine base.

External Descriptors

Not available

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