Compound Identification
SMILES
COCCOC1=NC2=C(N=C(Br)N2[C@@H]2CCC[C@H]2OCP(O)(O)=O)C(N)=N1
InChIKey
InChIKey=MXOWQCVDWQUDHF-RKDXNWHRSA-N
Formula
C14H21BrN5O6P
Mass
466.229
Taxonomic Classification
Taxonomy Tree
Kingdom
Organic compounds
Superclass
Nucleosides, nucleotides, and analogues
Class
Nucleoside and nucleotide analogues
Subclass
Phosphonated cyclopentyl nucleosides
Intermediate Tree Nodes
1,2-substituted phosphonated cyclopentyl nucleosides
Direct Parent
1,2-substituted phosphonated cyclopentyl purine nucleosides
Alternative Parents
6-aminopurines Aminopyrimidines and derivatives Alkyl aryl ethers N-substituted imidazoles Imidolactams Aryl bromides Organic phosphonic acids Heteroaromatic compounds Dialkyl ethers Azacyclic compounds Primary amines Organophosphorus compounds Organobromides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,2-substituted phosphonated cyclopentyl purine nucleoside - 6-aminopurine - Purine - Imidazopyrimidine - Alkyl aryl ether - Aminopyrimidine - Aryl bromide - Aryl halide - Imidolactam - Pyrimidine - N-substituted imidazole - Heteroaromatic compound - Azole - Imidazole - Organophosphonic acid - Organophosphonic acid derivative - Azacycle - Organoheterocyclic compound - Dialkyl ether - Ether - Organophosphorus compound - Primary amine - Organic oxide - Amine - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organohalogen compound - Organonitrogen compound - Organobromide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 1,2-substituted phosphonated cyclopentyl purine nucleosides. These are nucleoside analogues with a structure that consists of a cyclobutane that is substituted a the 1-position with a phosphonate group, and at the 2-position with either a purine base.
External Descriptors
Not available