Compound Identification
SMILES
CS(O)(=O)=O.NC(=O)NO.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.CC1=C(C=CC=C1O)C(=O)N[C@@H](CSC1=CC=CC=C1)[C@H](O)CN1C[C@H]2CCCC[C@H]2C[C@H]1C(=O)NC(C)(C)C
InChIKey
InChIKey=OKHHZORWOHIUFN-YYDUYMIOSA-N
Formula
C52H76N10O16S3
Mass
1193.41
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 amides o-Toluamides Benzamides Piperidinecarboxamides Benzoyl derivatives Thiophenol ethers Ortho cresols 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids Alkylarylthioethers Aminopyrimidines and derivatives Pyrimidones Hydropyrimidines Imidolactams Vinylogous amides Alkanesulfonic acids Dihydrofurans Heteroaromatic compounds Oxathiolanes Methanesulfonates Monothioacetals Organosulfonic acids Sulfonyls 1,2-aminoalcohols Trialkylamines Lactams Secondary carboxylic acid amides Secondary alcohols Ureas Sulfenyl compounds Azacyclic compounds Oxacyclic compounds Hydrocarbon derivatives Primary amines Carbonyl compounds Primary alcohols Organic oxides
Molecular Framework
Not available
Substituents
3'-thia pyrimidine nucleoside - Alpha-amino acid amide - Alpha-amino acid or derivatives - Benzamide - Benzoic acid or derivatives - O-toluamide - Toluamide - 2-piperidinecarboxamide - Piperidinecarboxamide - Aryl thioether - Benzoyl - O-cresol - Thiophenol ether - 1-hydroxy-4-unsubstituted benzenoid - Aminopyrimidine - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Pyrimidone - Toluene - Alkylarylthioether - Monocyclic benzene moiety - Benzenoid - Piperidine - Hydropyrimidine - Imidolactam - Pyrimidine - Monothioacetal - Methanesulfonate - Alkanesulfonic acid - Oxathiolane - Heteroaromatic compound - Dihydrofuran - Vinylogous amide - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Organosulfonic acid - Carboxamide group - Tertiary amine - 1,2-aminoalcohol - Secondary alcohol - Secondary carboxylic acid amide - Urea - Lactam - Tertiary aliphatic amine - Amino acid or derivatives - Sulfenyl compound - Oxacycle - Organoheterocyclic compound - Thioether - Carboxylic acid derivative - Azacycle - Amine - Carbonyl group - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organic nitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Primary alcohol - Alcohol - Primary amine - 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