Structure Information
Structure

Compound Identification

SMILES

[Na+].CCCCCCCCCCCCCCCC(=O)OC[C@@H](COP([O-])(=O)OC[C@H]1O[C@H]([C@@H](F)[C@@H]1O)N1C=NC2=C1N=C(Cl)N=C2N)OC(=O)CCCCCCCCCCCCCCC

InChIKey

InChIKey=PKNUTKXSSFFFFO-USXVRVPXSA-M

Formula

C45H77ClFN5NaO10P

Mass

956.55

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Nucleosides, nucleotides, and analogues

Class

Purine nucleotides

Subclass

Purine deoxyribonucleotides

Intermediate Tree Nodes

Purine deoxyribonucleoside monophosphates

Direct Parent

Purine 2'-deoxyribonucleoside monophosphates

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Purine 2'-deoxyribonucleoside monophosphate - 6-aminopurine - Glycerophospholipid - Purine - Imidazopyrimidine - Aminopyrimidine - 2-halopyrimidine - Dialkyl phosphate - Fatty acid ester - Halopyrimidine - Phosphoric acid ester - Aryl chloride - Aryl halide - Pyrimidine - Fatty acyl - Dicarboxylic acid or derivatives - Imidolactam - N-substituted imidazole - Organic phosphoric acid derivative - Alkyl phosphate - Heteroaromatic compound - Oxolane - Azole - Imidazole - Amino acid or derivatives - Carboxylic acid ester - Fluorohydrin - Halohydrin - Secondary alcohol - Organic metal halide - Carboxylic acid derivative - Oxacycle - Azacycle - Organic alkali metal salt - Organoheterocyclic compound - Organochloride - Organofluoride - Alkyl halide - Alkyl fluoride - Organonitrogen compound - Organooxygen compound - Alcohol - Amine - Carbonyl group - Hydrocarbon derivative - Organic oxide - Primary amine - Organic oxygen compound - Organic sodium salt - Organic nitrogen compound - Organic salt - Organohalogen compound - Organic zwitterion - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as purine 2'-deoxyribonucleoside monophosphates. These are purine nucleotides with monophosphate group linked to the ribose moiety lacking a hydroxyl group at position 2.

External Descriptors

Not available

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