Compound Identification
SMILES
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=ZRUGNYXOHJWYLH-GUDVDZBRSA-N
Formula
C25H22ClN5O4
Mass
491.93
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 Benzoyl derivatives Aminopyrimidines and derivatives Halopyrimidines Aryl chlorides N-substituted imidazoles Heteroaromatic compounds Carboxylic acid esters Amino acids and derivatives Azacyclic compounds Hydrocarbon derivatives Organic oxides Organochlorides Organooxygen compounds Primary amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cyclobutyl purine nucleoside - Cyclobutyl nucleoside - Benzoate ester - Benzoic acid or derivatives - Imidazopyrimidine - Purine - Benzoyl - Aminopyrimidine - Halopyrimidine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Pyrimidine - N-substituted imidazole - Heteroaromatic compound - Azole - Imidazole - Amino acid or derivatives - Carboxylic acid ester - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Organooxygen compound - Primary amine - Organic nitrogen compound - Amine - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organohalogen compound - Organochloride - 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