Compound Identification
SMILES
CCOC(=O)[C@H](CCSC[C@H]1O[C@H]([C@H](O)[C@@H]1O)N1C=NC2=C1N=CN=C2N)NC(=O)OC(C)(C)C
InChIKey
InChIKey=YTBYRJSEGDHFIX-URQYDQELSA-N
Formula
C21H32N6O7S
Mass
512.58
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Nucleosides, nucleotides, and analogues
-
Class
5'-deoxyribonucleosides
- Subclass 5'-deoxy-5'-thionucleosides
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Class
5'-deoxyribonucleosides
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Superclass
Nucleosides, nucleotides, and analogues
Kingdom
Organic compounds
Superclass
Nucleosides, nucleotides, and analogues
Class
5'-deoxyribonucleosides
Subclass
5'-deoxy-5'-thionucleosides
Intermediate Tree Nodes
Not available
Direct Parent
5'-deoxy-5'-thionucleosides
Alternative Parents
Alpha amino acid esters Glycosylamines 6-aminopurines Pentoses Aminopyrimidines and derivatives Fatty acid esters Imidolactams N-substituted imidazoles Carbamate esters Oxolanes Heteroaromatic compounds Secondary alcohols Carboxylic acid esters 1,2-diols Oxacyclic compounds Sulfenyl compounds Dialkylthioethers Azacyclic compounds Monocarboxylic acids and derivatives Carbonyl compounds Primary amines Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
5'-deoxy-5'-thionucleoside - Alpha-amino acid ester - N-glycosyl compound - Glycosyl compound - 6-aminopurine - Alpha-amino acid or derivatives - Pentose monosaccharide - Imidazopyrimidine - Purine - Aminopyrimidine - Fatty acid ester - Monosaccharide - Fatty acyl - Pyrimidine - N-substituted imidazole - Imidolactam - Carbamic acid ester - Heteroaromatic compound - Oxolane - Imidazole - Azole - Carboxylic acid ester - Secondary alcohol - Amino acid or derivatives - 1,2-diol - Oxacycle - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Dialkylthioether - Sulfenyl compound - Thioether - Monocarboxylic acid or derivatives - Organic oxide - Carbonyl group - Alcohol - Hydrocarbon derivative - Amine - Organic nitrogen compound - Primary amine - Organosulfur compound - Organooxygen compound - Organic oxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 5'-deoxy-5'-thionucleosides. These are 5'-deoxyribonucleosides in which the ribose is thio-substituted at the 5'position by a S-alkyl group.
External Descriptors
Not available