Compound Identification
SMILES
ClC1=CC=C(C=C1)S(=O)(=O)C1=NC(NC(=O)CC2=CC=CC=C2)=NC2=C1N=CN2C1CC(COCC2=CC=CC=C2)C1
InChIKey
InChIKey=ADZJPQPPDHJKQW-UHFFFAOYSA-N
Formula
C31H28ClN5O4S
Mass
602.11
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Nucleosides, nucleotides, and analogues
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Class
Nucleoside and nucleotide analogues
- Subclass Cyclobutyl nucleosides
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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
Cyclobutyl nucleosides
Intermediate Tree Nodes
Not available
Direct Parent
Cyclobutyl nucleosides
Alternative Parents
Phenylacetamides Benzenesulfonyl compounds Benzylethers Purines and purine derivatives N-arylamides Chlorobenzenes N-substituted imidazoles Aryl chlorides Pyrimidines and pyrimidine derivatives Heteroaromatic compounds Sulfones Secondary carboxylic acid amides Dialkyl ethers Azacyclic compounds Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cyclobutyl purine nucleoside - Cyclobutyl nucleoside - Phenylacetamide - Benzylether - Benzenesulfonyl group - Imidazopyrimidine - Purine - N-arylamide - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - N-substituted imidazole - Pyrimidine - Benzenoid - Sulfonyl - Heteroaromatic compound - Sulfone - Imidazole - Azole - Secondary carboxylic acid amide - Carboxamide group - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Dialkyl ether - Ether - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Carbonyl group - Organooxygen compound - Organosulfur compound - Organic oxide - Organochloride - Hydrocarbon derivative - Organohalogen 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