Structure Information
Structure

Compound Identification

SMILES

OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)C1=NC2=C(N1)C=C(C=C2)C(=O)NCC1=CC(=CC=C1)C(F)(F)F

InChIKey

InChIKey=WPBCCTKKKOFQEV-BRSBDYLESA-N

Formula

C21H20F3N3O5

Mass

451.402

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Nucleosides, nucleotides, and analogues

Class

Nucleoside and nucleotide analogues

Subclass

2-ribofuranosylbenzimidazoles

Intermediate Tree Nodes

Not available

Direct Parent

2-ribofuranosylbenzimidazoles

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

2-ribofuranosylbenzimidazole - Glycosyl compound - C-glycosyl compound - Pentose monosaccharide - Trifluoromethylbenzene - Benzimidazole - Monosaccharide - Monocyclic benzene moiety - Benzenoid - Azole - Imidazole - Oxolane - Heteroaromatic compound - Carboxamide group - Secondary carboxylic acid amide - Secondary alcohol - 1,2-diol - Oxacycle - Azacycle - Carboxylic acid derivative - Dialkyl ether - Ether - Organoheterocyclic compound - Alkyl halide - Alkyl fluoride - Alcohol - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Primary alcohol - Organooxygen compound - Organohalogen compound - Organofluoride - Organonitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 2-ribofuranosylbenzimidazoles. These are nucleoside and nucleotide analogs with a structure that consists of a benzimidazole ring system which is N-substituted at the 2-position with a ribose moiety. Nucleotide analogues contain a phosphate group linked to the C5 carbon atom of the furanose.

External Descriptors

Not available

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