Compound Identification
SMILES
OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@H]1O)C1=NC2=CC=CC=C2N1
InChIKey
InChIKey=XEMMGXXVANKOFH-YBXAARCKSA-N
Formula
C13H16N2O5
Mass
280.28
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
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
-
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
Hexoses C-glycosyl compounds Benzimidazoles Oxanes Benzenoids Imidazoles Heteroaromatic compounds Secondary alcohols 1,2-diols Oxacyclic compounds Dialkyl ethers Azacyclic compounds Primary alcohols Organonitrogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-pyranosylbenzimidazole - Hexose monosaccharide - C-glycosyl compound - Glycosyl compound - Benzimidazole - Benzenoid - Monosaccharide - Oxane - Azole - Heteroaromatic compound - Imidazole - 1,2-diol - Secondary alcohol - Oxacycle - Dialkyl ether - Ether - Azacycle - Organoheterocyclic compound - Polyol - Alcohol - Organic oxygen compound - Hydrocarbon derivative - Primary alcohol - Organic nitrogen compound - Organonitrogen compound - 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