Structure Information
Structure

Compound Identification

SMILES

OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)C1=NC2=C(N1)C=C(NC(=O)NC1=CC=CC(=C1)C(F)(F)F)C=C2

InChIKey

InChIKey=BOZLDSOPCSUACA-UYTYNIKBSA-N

Formula

C21H21F3N4O6

Mass

482.416

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Nucleosides, nucleotides, and analogues

Class

Nucleoside and nucleotide analogues

Subclass

2-pyranosylbenzimidazoles

Intermediate Tree Nodes

Not available

Direct Parent

2-pyranosylbenzimidazoles

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

2-pyranosylbenzimidazole - Hexose monosaccharide - Glycosyl compound - C-glycosyl compound - Trifluoromethylbenzene - N-phenylurea - Benzimidazole - Monosaccharide - Benzenoid - Monocyclic benzene moiety - Oxane - Heteroaromatic compound - Azole - Imidazole - 1,2-diol - Urea - Secondary alcohol - Ether - Dialkyl ether - Polyol - Organoheterocyclic compound - Azacycle - Oxacycle - Organic nitrogen compound - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Carbonyl group - Primary alcohol - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Alkyl halide - Alkyl fluoride - Alcohol - Aromatic heteropolycyclic compound

Description

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

External Descriptors

Not available

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