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Structure Information
Structure

Compound Identification

SMILES

NC1=NC(=O)N(C=C1)[C@@H]1CS[C@H](CO)O1.CC1=CN([C@H]2C[C@H](N=[N+]=[N-])[C@@H](CO)O2)C(=O)NC1=O.FC(F)(F)[C@]1(OC(=O)NC2=C1C=C(Cl)C=C2)C#CC1CC1

InChIKey

InChIKey=QAKBUHQAZKGKRN-XLPDAYHQSA-N

Formula

C32H33ClF3N9O9S

Mass

812.18

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Nucleosides, nucleotides, and analogues

Class

Pyrimidine nucleosides

Subclass

Pyrimidine 2',3'-dideoxyribonucleosides

Intermediate Tree Nodes

Not available

Direct Parent

Pyrimidine 2',3'-dideoxyribonucleosides

Alternative Parents

Molecular Framework

Not available

Substituents

Pyrimidine 2',3'-dideoxyribonucleoside - 3'-thia pyrimidine nucleoside - Benzoxazine - Aminopyrimidine - Pyrimidone - Hydropyrimidine - Aryl chloride - Pyrimidine - Aryl halide - Ynone - Benzenoid - Imidolactam - Oxathiolane - Monothioacetal - Carbamic acid ester - Heteroaromatic compound - Oxolane - Vinylogous amide - Azo compound - Urea - Lactam - Azo imide - Organoheterocyclic compound - Azacycle - Oxacycle - Alcohol - Organonitrogen compound - Organofluoride - Organochloride - Organohalogen compound - Organooxygen compound - Primary alcohol - Primary amine - Carbonyl group - Organic zwitterion - Organic salt - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Amine - Alkyl halide - Alkyl fluoride - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as pyrimidine 2',3'-dideoxyribonucleosides. These are compounds consisting of a pyrimidine linked to a ribose which lacks a hydroxyl group at positions 2 and 3.

External Descriptors

Not available

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