Compound Identification
SMILES
CC(C)C(=O)NC1=NC2=C(N=CN2[C@@H]2C[C@H](COC(=O)C3=CC=CC=C3)[C@H]2COC(=O)C2=CC=CC=C2)C(Cl)=N1
InChIKey
InChIKey=IXWQSFZJHOSQCK-YPAWHYETSA-N
Formula
C29H28ClN5O5
Mass
562.02
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Nucleosides, nucleotides, and analogues
-
Class
Nucleoside and nucleotide analogues
- Subclass Cyclobutyl nucleosides
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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
Cyclobutyl nucleosides
Intermediate Tree Nodes
Not available
Direct Parent
Cyclobutyl nucleosides
Alternative Parents
Benzoic acid esters Purines and purine derivatives N-arylamides Benzoyl derivatives Halopyrimidines N-substituted imidazoles Aryl chlorides Heteroaromatic compounds Secondary carboxylic acid amides Carboxylic acid esters Azacyclic compounds Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cyclobutyl purine nucleoside - Cyclobutyl nucleoside - Benzoate ester - Benzoic acid or derivatives - Purine - Imidazopyrimidine - N-arylamide - Benzoyl - Halopyrimidine - Aryl halide - Benzenoid - Aryl chloride - Pyrimidine - N-substituted imidazole - Monocyclic benzene moiety - Imidazole - Azole - Heteroaromatic compound - Carboxylic acid ester - Secondary carboxylic acid amide - Carboxamide group - Organoheterocyclic compound - Carboxylic acid derivative - Azacycle - Organic nitrogen compound - Organohalogen compound - Carbonyl group - Organochloride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as cyclobutyl nucleosides. These are nucleoside analogues with a structure that consists of a cyclobutane that is substituted a the 1-position with a hydroxyl group and at the 3- position with either a purine or pyrimidine base.
External Descriptors
Not available