Compound Identification
SMILES
OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@H]1O)C1=NC2=C(S1)C=CC(=C2)C(=O)NCC(F)(F)F
InChIKey
InChIKey=DSBCNFHZKLKUEK-UUWLPUTASA-N
Formula
C16H17F3N2O6S
Mass
422.38
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Nucleosides, nucleotides, and analogues
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Class
Nucleoside and nucleotide analogues
- Subclass 2-pyranosylbenzothiazoles
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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-pyranosylbenzothiazoles
Intermediate Tree Nodes
Not available
Direct Parent
2-pyranosylbenzothiazoles
Alternative Parents
Hexoses C-glycosyl compounds Benzothiazoles Oxanes Benzenoids Thiazoles Heteroaromatic compounds Secondary carboxylic acid amides Secondary alcohols 1,2-diols Azacyclic compounds Oxacyclic compounds Dialkyl ethers Organofluorides Organonitrogen compounds Alkyl fluorides Primary alcohols Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-pyranosylbenzothiazole - Hexose monosaccharide - C-glycosyl compound - Glycosyl compound - 1,3-benzothiazole - Monosaccharide - Oxane - Benzenoid - Azole - Heteroaromatic compound - Thiazole - 1,2-diol - Carboxamide group - Secondary alcohol - Secondary carboxylic acid amide - Organoheterocyclic compound - Polyol - Carboxylic acid derivative - Dialkyl ether - Ether - Azacycle - Oxacycle - Alkyl halide - Hydrocarbon derivative - Organohalogen compound - Organofluoride - Organonitrogen compound - Alcohol - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Primary alcohol - Alkyl fluoride - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 2-pyranosylbenzothiazoles. These are nucleoside and nucleotide analogs with a structure that consists of a benzothiazole base 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