Compound Identification
SMILES
ClC1=CC=C(C=C1)C(=O)OC[C@H]1O[C@H]([C@H](OC(=O)C2=CC=C(Cl)C=C2)[C@@H]1OC(=O)C1=CC=C(Cl)C=C1)N1N=C2C=CC=CC2=N1
InChIKey
InChIKey=CAUUGKASOXUFSW-CXDXLJMYSA-N
Formula
C32H22Cl3N3O7
Mass
666.89
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Nucleosides, nucleotides, and analogues
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Class
Nucleoside and nucleotide analogues
- Subclass 2-ribofuranosylbenzotriazoles
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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-ribofuranosylbenzotriazoles
Intermediate Tree Nodes
Not available
Direct Parent
2-ribofuranosylbenzotriazoles
Alternative Parents
4-halobenzoic acids and derivatives Benzoic acid esters Benzotriazoles Benzoyl derivatives Chlorobenzenes Aryl chlorides Monosaccharides Triazoles Oxolanes Heteroaromatic compounds Carboxylic acid esters Oxacyclic compounds Azacyclic compounds Organochlorides Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-ribofuranosylbenzotriazole - Benzoate ester - 4-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzoic acid or derivatives - Benzotriazole - Benzoyl - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Benzenoid - Monocyclic benzene moiety - Monosaccharide - Azole - Heteroaromatic compound - 1,2,3-triazole - Triazole - Oxolane - Carboxylic acid ester - Azacycle - Oxacycle - Carboxylic acid derivative - Organoheterocyclic compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 2-ribofuranosylbenzotriazoles. These are nucleoside and nucleotide analogs with a structure that consists of a benzotriazole ring system which is N-substituted at the 2-position with a ribose moiety. Nucleotide analogues contain a phosphate group linked to the C5 carbon atom of the furanose.
External Descriptors
Not available