Structure Information
Structure

Compound Identification

SMILES

OC[C@@H]1O[C@H]([C@@H](O)[C@H](O)[C@@H]1O)N1C2=C(C=C(Cl)C=C2)N=C1C1=CC=C(O1)[N+]([O-])=O

InChIKey

InChIKey=QNDRYEFAUUBHLB-XCALXHAASA-N

Formula

C17H16ClN3O8

Mass

425.78

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Nucleosides, nucleotides, and analogues

Class

Nucleoside and nucleotide analogues

Subclass

1-pyranosylbenzimidazoles

Intermediate Tree Nodes

Not available

Direct Parent

1-pyranosylbenzimidazoles

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

1-pyranosylbenzimidazole - Hexose monosaccharide - Glycosyl compound - N-glycosyl compound - Benzimidazole - Nitroaromatic compound - 2-nitrofuran - Aryl chloride - Aryl halide - Monosaccharide - N-substituted imidazole - Oxane - Benzenoid - Furan - Imidazole - Azole - Heteroaromatic compound - Organic nitro compound - 1,2-diol - C-nitro compound - Secondary alcohol - Polyol - Oxacycle - Organic 1,3-dipolar compound - Organic oxoazanium - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organoheterocyclic compound - Azacycle - Organic salt - Organic zwitterion - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organohalogen compound - Organic nitrogen compound - Organochloride - Organonitrogen compound - Alcohol - Organooxygen compound - Primary alcohol - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 1-pyranosylbenzimidazoles. These are nucleoside and nucleotide analogs with a structure that consists of a Benzimidazole which is N-substituted at the 1-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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