Structure Information
Structure

Compound Identification

SMILES

CCCCCCCCCCCCS(=O)(=O)CC(COP(O)(=O)OC[C@H]1O[C@H]([C@@H](F)[C@@H]1O)N1C=NC2=C1N=C(Cl)N=C2N)OCCCCCCCCCC

InChIKey

InChIKey=SDOITTYGMKVDLU-VETMKXQESA-N

Formula

C35H62ClFN5O9PS

Mass

814.39

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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 - Imidazopyrimidine - Purine - Aminopyrimidine - 2-halopyrimidine - Dialkyl phosphate - Halopyrimidine - Aryl chloride - Aryl halide - Organic phosphoric acid derivative - N-substituted imidazole - Phosphoric acid ester - Imidolactam - Alkyl phosphate - Pyrimidine - Heteroaromatic compound - Azole - Imidazole - Sulfone - Sulfonyl - Oxolane - Fluorohydrin - Halohydrin - Secondary alcohol - Oxacycle - Dialkyl ether - Ether - Azacycle - Organoheterocyclic compound - Organosulfur compound - Primary amine - Amine - Alkyl halide - Alkyl fluoride - Alcohol - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organohalogen compound - Organofluoride - Organochloride - 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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