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
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Nucleosides, nucleotides, and analogues
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Class
Nucleoside and nucleotide analogues
- Subclass 1-pyranosylbenzimidazoles
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Class
Nucleoside and nucleotide analogues
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Superclass
Nucleosides, nucleotides, and analogues
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
Hexoses Glycosylamines Benzimidazoles Nitroaromatic compounds Nitrofurans Oxanes Benzenoids N-substituted imidazoles Aryl chlorides Heteroaromatic compounds Secondary alcohols 1,2-diols Oxacyclic compounds Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Organic salts Hydrocarbon derivatives Primary alcohols Organic zwitterions Organonitrogen compounds Organochlorides Organic oxides
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