Compound Identification
SMILES
NC1=NC2=C(N=CN2CC2(Br)C(COCC3=CC=CC=C3)C2(F)F)C(Cl)=N1
InChIKey
InChIKey=MNJLWZBVWFSWCH-UHFFFAOYSA-N
Formula
C17H15BrClF2N5O
Mass
458.69
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Nucleosides, nucleotides, and analogues
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Class
Nucleoside and nucleotide analogues
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Subclass
Cyclopropyl nucleosides
- Level 5 Cyclopropyl purine nucleosides
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Subclass
Cyclopropyl 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
Cyclopropyl nucleosides
Intermediate Tree Nodes
Not available
Direct Parent
Cyclopropyl purine nucleosides
Alternative Parents
Purines and purine derivatives Benzylethers Aminopyrimidines and derivatives Halopyrimidines Aryl chlorides N-substituted imidazoles Heteroaromatic compounds Azacyclic compounds Dialkyl ethers Alkyl fluorides Organochlorides Alkyl bromides Organofluorides Primary amines Organobromides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cyclopropyl purine nucleoside - Benzylether - Purine - Imidazopyrimidine - Aminopyrimidine - Halopyrimidine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Pyrimidine - N-substituted imidazole - Azole - Heteroaromatic compound - Imidazole - Azacycle - Dialkyl ether - Ether - Organoheterocyclic compound - Organonitrogen compound - Alkyl halide - Primary amine - Organooxygen compound - Organohalogen compound - Organobromide - Alkyl fluoride - Alkyl bromide - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Amine - Organochloride - Organofluoride - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as cyclopropyl purine nucleosides. These are nucleoside analogues with a structure that consists of a cyclopropane that is substituted a the 1-position with a hydroxyl group and at the 2- position with either a purine base.
External Descriptors
Not available