Compound Identification
SMILES
OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@H]1O)C1=NC2=C(N1)C=C(C=C2)C(=O)NC1=CC(Cl)=C(F)C=C1
InChIKey
InChIKey=YHYDWDYYBWCQGU-DISONHOPSA-N
Formula
C20H19ClFN3O6
Mass
451.84
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Nucleosides, nucleotides, and analogues
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Class
Nucleoside and nucleotide analogues
- Subclass 2-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
2-pyranosylbenzimidazoles
Intermediate Tree Nodes
Not available
Direct Parent
2-pyranosylbenzimidazoles
Alternative Parents
Aromatic anilides Hexoses C-glycosyl compounds Benzimidazoles Chlorobenzenes Fluorobenzenes Oxanes Aryl chlorides Aryl fluorides Heteroaromatic compounds Imidazoles Secondary alcohols 1,2-diols Secondary carboxylic acid amides Oxacyclic compounds Dialkyl ethers Azacyclic compounds Primary alcohols Organic oxides Organochlorides Organofluorides Organonitrogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-pyranosylbenzimidazole - Aromatic anilide - Hexose monosaccharide - Glycosyl compound - C-glycosyl compound - Benzimidazole - Halobenzene - Fluorobenzene - Chlorobenzene - Aryl halide - Benzenoid - Aryl chloride - Aryl fluoride - Monosaccharide - Oxane - Monocyclic benzene moiety - Imidazole - Azole - Heteroaromatic compound - 1,2-diol - Carboxamide group - Secondary carboxylic acid amide - Secondary alcohol - Oxacycle - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Dialkyl ether - Ether - Polyol - Organonitrogen compound - Alcohol - Organofluoride - Organohalogen compound - Organochloride - Organic oxygen compound - Organic oxide - Organic nitrogen compound - Primary alcohol - Hydrocarbon derivative - Organooxygen 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