Compound Identification
SMILES
CCSC[C@H]1O[C@H]([C@H](O)[C@@H]1O)N1C=NC2=C1N=C(I)N=C2N
InChIKey
InChIKey=KNTRGNQLWHTVLA-IOSLPCCCSA-N
Formula
C12H16IN5O3S
Mass
437.26
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
Glycosylamines 6-aminopurines Pentoses 2-halopyrimidines Aminopyrimidines and derivatives Aryl iodides Imidolactams N-substituted imidazoles Tetrahydrofurans Heteroaromatic compounds 1,2-diols Secondary alcohols Sulfenyl compounds Dialkylthioethers Azacyclic compounds Oxacyclic compounds Hydrocarbon derivatives Primary amines Organoiodides Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
5'-deoxy-5'-thionucleoside - Glycosyl compound - N-glycosyl compound - 6-aminopurine - Pentose monosaccharide - Imidazopyrimidine - Purine - Aminopyrimidine - 2-halopyrimidine - Halopyrimidine - Aryl halide - Aryl iodide - Monosaccharide - N-substituted imidazole - Pyrimidine - Imidolactam - Tetrahydrofuran - Azole - Heteroaromatic compound - Imidazole - Secondary alcohol - 1,2-diol - Sulfenyl compound - Thioether - Dialkylthioether - Organoheterocyclic compound - Azacycle - Oxacycle - Organosulfur compound - Alcohol - Primary amine - Hydrocarbon derivative - Organopnictogen compound - Amine - Organic nitrogen compound - Organohalogen compound - Organic oxygen compound - Organoiodide - Organonitrogen compound - Organooxygen 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