Compound Identification
SMILES
NC1=NC(=O)N(C=C1F)[C@@H]1CS[C@H](CO)O1.CC(C)OC(=O)[C@H](C)N[P@@](=O)(CO[C@H](C)CN1C=NC2=C1N=CN=C2N)OC1=CC=CC=C1
InChIKey
InChIKey=NEPFAYPIICYVCG-NMDHCELSSA-N
Formula
C29H39FN9O8PS
Mass
723.72
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Nucleosides, nucleotides, and analogues
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
Alpha amino acid esters Alanine and derivatives 6-aminopurines Phenoxy compounds Pyrimidones Halopyrimidines Aminopyrimidines and derivatives Hydropyrimidines Imidolactams Phosphonic amide esters N-substituted imidazoles Phosphonic acid esters Aryl fluorides Monothioacetals Heteroaromatic compounds Oxathiolanes Carboxylic acid esters Oxacyclic compounds Azacyclic compounds Monocarboxylic acids and derivatives Carbonyl compounds Primary alcohols Organofluorides Organophosphorus compounds Organic oxides Primary amines Hydrocarbon derivatives
Molecular Framework
Not available
Substituents
3'-thia pyrimidine nucleoside - Alpha-amino acid ester - Alanine or derivatives - 6-aminopurine - Alpha-amino acid or derivatives - Imidazopyrimidine - Purine - Phenoxy compound - Halopyrimidine - Aminopyrimidine - Pyrimidone - Imidolactam - Phosphonic amide ester - Benzenoid - Monocyclic benzene moiety - Pyrimidine - N-substituted imidazole - Hydropyrimidine - Aryl fluoride - Phosphonic acid ester - Aryl halide - Heteroaromatic compound - Imidazole - Monothioacetal - Organophosphonic acid derivative - Azole - Oxathiolane - Carboxylic acid ester - Amino acid or derivatives - Azacycle - Oxacycle - Carboxylic acid derivative - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Organic nitrogen compound - Organohalogen compound - Organofluoride - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organophosphorus compound - Primary alcohol - Primary amine - Hydrocarbon derivative - Amine - Organic oxide - Organic oxygen compound - Alcohol - 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