Structure Information
Structure

Compound Identification

SMILES

CC1=CC=CC=C1CNC(=O)C1=CC2=C(C=C1)N=C(N2)[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O

InChIKey

InChIKey=HEOSSUJOMPVIMB-LCWAXJCOSA-N

Formula

C22H25N3O6

Mass

427.457

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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 - C-glycosyl compound - Glycosyl compound - Benzimidazole - Toluene - Monosaccharide - Oxane - Monocyclic benzene moiety - Benzenoid - Azole - Imidazole - Heteroaromatic compound - 1,2-diol - Secondary alcohol - Secondary carboxylic acid amide - Carboxamide group - Oxacycle - Azacycle - Carboxylic acid derivative - Dialkyl ether - Ether - Organoheterocyclic compound - Polyol - Alcohol - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Primary alcohol - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - 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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