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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]2O[C@H](CO)C=C2)C(=O)NC1=O.FC(F)(F)[C@]1(OC(=O)NC2=C1C=C(Cl)C=C2)C#CC1CC1

InChIKey

InChIKey=YKEWSVHEFQBOGE-IMWSQAIJSA-N

Formula

C32H32ClF3N6O9S

Mass

769.15

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Nucleosides, nucleotides, and analogues

Class

Nucleoside and nucleotide analogues

Subclass

3'-thia pyrimidine nucleosides

Intermediate Tree Nodes

Not available

Direct Parent

3'-thia pyrimidine nucleosides

Alternative Parents

Molecular Framework

Not available

Substituents

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

Description

This compound belongs to the class of organic compounds known as 3'-thia pyrimidine nucleosides. These are nucleoside analogues with a structure that consists of a pyrimidine base, which is N-substituted at the 1-position with a 3'-thia derivative (1,3-oxazolidine) of the ribose moiety that is characteristic of nucleosides.

External Descriptors

Not available

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