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
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Nucleosides, nucleotides, and analogues
- Class Pyrimidine nucleosides
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Superclass
Nucleosides, nucleotides, and analogues
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
3'-thia pyrimidine nucleosides Benzoxazines Aminopyrimidines and derivatives Pyrimidones Ynones Aryl chlorides Benzenoids Hydropyrimidines Imidolactams Vinylogous amides Oxolanes Carbamate esters Heteroaromatic compounds Oxathiolanes Monothioacetals Lactams Ureas Azo imides Azo compounds Oxacyclic compounds Azacyclic compounds Hydrocarbon derivatives Primary amines Alkyl fluorides Primary alcohols Organic oxides Organic salts Organic zwitterions Organochlorides Organofluorides
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