Compound Identification
SMILES
NC1=NC=NC2=C1N=CN2[C@@H]1O[C@H](CSC2=CC=C(C=C2)[N+]([O-])=O)C(O)C1O
InChIKey
InChIKey=FBKPPTASIYMHFC-VHBSBENZSA-N
Formula
C16H16N6O5S
Mass
404.4
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 Nitrobenzenes Thiophenol ethers Nitroaromatic compounds Alkylarylthioethers Aminopyrimidines and derivatives Imidolactams N-substituted imidazoles Heteroaromatic compounds Oxolanes 1,2-diols Secondary alcohols Oxacyclic compounds Sulfenyl compounds Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Organic salts Organic zwitterions Hydrocarbon derivatives Primary amines Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
5'-deoxy-5'-thionucleoside - Glycosyl compound - N-glycosyl compound - 6-aminopurine - Pentose monosaccharide - Imidazopyrimidine - Nitrobenzene - Purine - Aryl thioether - Nitroaromatic compound - Thiophenol ether - Aminopyrimidine - Alkylarylthioether - Monocyclic benzene moiety - Monosaccharide - N-substituted imidazole - Pyrimidine - Benzenoid - Imidolactam - Azole - Imidazole - Heteroaromatic compound - Oxolane - 1,2-diol - Secondary alcohol - C-nitro compound - Organic nitro compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Sulfenyl compound - Organoheterocyclic compound - Thioether - Oxacycle - Organic oxoazanium - Azacycle - Organic nitrogen compound - Organic oxygen compound - Organic salt - Hydrocarbon derivative - Alcohol - Amine - Organic zwitterion - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Primary amine - Organic oxide - 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