Compound Identification
SMILES
CC1=CC=C(C=C1)S([O-])(=O)=O.C[S+](CC[C@H](N)C(O)=O)CC1OC(C(O)C1O)N1C=NC2=C1N=CN=C2N
InChIKey
InChIKey=VHPOFDUCFKOUHV-OGUPVBQMSA-N
Formula
C22H30N6O8S2
Mass
570.64
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Nucleosides, nucleotides, and analogues
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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
Methionine and derivatives p-Methylbenzenesulfonates Glycosylamines Tosyl compounds L-alpha-amino acids 6-aminopurines Pentoses 1-sulfo,2-unsubstituted aromatic compounds Benzenesulfonyl compounds Aminopyrimidines and derivatives Thia fatty acids Hydroxy fatty acids N-substituted imidazoles Imidolactams Organosulfonic acids Heteroaromatic compounds Oxolanes Sulfonyls 1,2-diols Amino acids Secondary alcohols Oxacyclic compounds Monocarboxylic acids and derivatives Azacyclic compounds Carboxylic acids Monoalkylamines Organic oxides Hydrocarbon derivatives Carbonyl compounds Organic zwitterions
Molecular Framework
Not available
Substituents
5'-deoxy-5'-thionucleoside - Methionine or derivatives - Glycosyl compound - N-glycosyl compound - P-methylbenzenesulfonate - 6-aminopurine - Alpha-amino acid - Alpha-amino acid or derivatives - Pentose monosaccharide - L-alpha-amino acid - Benzenesulfonate - Tosyl compound - Arylsulfonic acid or derivatives - Benzenesulfonyl group - Imidazopyrimidine - Purine - 1-sulfo,2-unsubstituted aromatic compound - Aminopyrimidine - Toluene - Thia fatty acid - Hydroxy fatty acid - Fatty acyl - Imidolactam - Benzenoid - Monocyclic benzene moiety - Monosaccharide - N-substituted imidazole - Pyrimidine - Heteroaromatic compound - Azole - Sulfonyl - Organosulfonic acid - Imidazole - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Oxolane - Amino acid or derivatives - Secondary alcohol - 1,2-diol - Amino acid - Monocarboxylic acid or derivatives - Azacycle - Organoheterocyclic compound - Oxacycle - Carboxylic acid derivative - Carboxylic acid - Amine - Organic nitrogen compound - Carbonyl group - Organic oxide - Organic zwitterion - Alcohol - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Primary aliphatic amine - Hydrocarbon derivative - Primary amine - Organic oxygen 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