Compound Identification
SMILES
OC[C@@H]1[C@@H](COC(=O)C2=CC=CC=C2)C[C@H]1N1C=NC2=C1N=CN=C2Cl
InChIKey
InChIKey=CDURXQQGCRVCMR-MGPQQGTHSA-N
Formula
C18H17ClN4O3
Mass
372.81
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 Halopyrimidines N-substituted imidazoles Aryl chlorides Heteroaromatic compounds Carboxylic acid esters Azacyclic compounds Primary alcohols Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cyclobutyl purine nucleoside - Cyclobutyl nucleoside - Benzoate ester - Benzoic acid or derivatives - Imidazopyrimidine - Purine - Benzoyl - Halopyrimidine - Benzenoid - Pyrimidine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - N-substituted imidazole - Heteroaromatic compound - Azole - Imidazole - Carboxylic acid ester - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Alcohol - Organic oxygen compound - Organic nitrogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Primary alcohol - 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