Compound Identification
SMILES
CCN(CC)CC.NC1=NC=NC2=C1N=CN2C1OC2COP(O)(=S)OC2C1O
InChIKey
InChIKey=OXIPZMKSNMRTIV-UHFFFAOYSA-N
Formula
C16H27N6O5PS
Mass
446.46
Taxonomic Classification
Taxonomy Tree
- Kingdom Organic compounds
Kingdom
Organic compounds
Superclass
Nucleosides, nucleotides, and analogues
Class
Nucleoside and nucleotide analogues
Subclass
3',5'-cyclic purine nucleoside phosphorothioates
Intermediate Tree Nodes
Not available
Direct Parent
3',5'-cyclic purine nucleoside phosphorothioates
Alternative Parents
Glycosylamines 6-aminopurines Thiophosphate diesters Aminopyrimidines and derivatives N-substituted imidazoles Monosaccharides Imidolactams Oxolanes Heteroaromatic compounds Trialkylamines Secondary alcohols Oxacyclic compounds Azacyclic compounds Primary amines Hydrocarbon derivatives
Molecular Framework
Not available
Substituents
3',5'-cyclic purine nucleoside phosphorothioate - Glycosyl compound - N-glycosyl compound - 6-aminopurine - Imidazopyrimidine - Purine - Aminopyrimidine - Thiophosphate diester - Monosaccharide - N-substituted imidazole - Imidolactam - Organic thiophosphoric acid or derivatives - Thiophosphoric acid ester - Pyrimidine - Azole - Heteroaromatic compound - Imidazole - Oxolane - Tertiary aliphatic amine - Tertiary amine - Secondary alcohol - Organoheterocyclic compound - Azacycle - Oxacycle - Organooxygen compound - Organonitrogen compound - Amine - Alcohol - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Primary amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 3',5'-cyclic purine nucleoside phosphorothioates. These are 3',5'-cyclic purine nucleoside phosphate analogues, where a phosphate oxygen has been exchanged for sulphur generating a chiral phosphorothioate. In 3',5'-cyclic nucleoside phosphorothioate, the oxygen atoms at the 3'- and 5'-positions of the ribose are part of the phosphorothioate group.
External Descriptors
Not available