Compound Identification
SMILES
[H]C1(COP(O)(=S)OC2([H])C([H])(COP(O)(O)=O)OC([H])(N3C=NC4=C3NC(=N)N=C4O)C2([H])OC)CC([H])(O)C([H])(O1)N1C=CC(=N)N=C1O
InChIKey
InChIKey=KJSPUXACKHWKQD-UHFFFAOYSA-N
Formula
C20H28N8O13P2S
Mass
682.49
Taxonomic Classification
Taxonomy Tree
- Kingdom Organic compounds
Kingdom
Organic compounds
Superclass
Nucleosides, nucleotides, and analogues
Class
(3'->5')-dinucleotides and analogues
Subclass
(3'->5')-dinucleotide phosphorothioates
Intermediate Tree Nodes
Not available
Direct Parent
(3'->5')-dinucleotide phosphorothioates
Alternative Parents
Purine ribonucleoside monophosphates Pentose phosphates Glycosylamines Monosaccharide phosphates Purines and purine derivatives Thiophosphate diesters Hydroxypyrimidines Monoalkyl phosphates Hydropyrimidines N-substituted imidazoles Heteroaromatic compounds Oxolanes Secondary alcohols Oxacyclic compounds Dialkyl ethers Azacyclic compounds Hydrocarbon derivatives Organonitrogen compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
(3'->5')-dinucleotide phosphorothioate - Purine ribonucleoside monophosphate - Pentose phosphate - Pentose-5-phosphate - Glycosyl compound - N-glycosyl compound - Monosaccharide phosphate - Imidazopyrimidine - Purine - Monoalkyl phosphate - Thiophosphate diester - Hydroxypyrimidine - Organic thiophosphoric acid or derivatives - Alkyl phosphate - Hydropyrimidine - Pyrimidine - Monosaccharide - Phosphoric acid ester - N-substituted imidazole - Organic phosphoric acid derivative - Thiophosphoric acid ester - Imidazole - Heteroaromatic compound - Oxolane - Azole - Secondary alcohol - Organoheterocyclic compound - Azacycle - Ether - Oxacycle - Dialkyl ether - Hydrocarbon derivative - Alcohol - Organic oxygen compound - Organic nitrogen compound - Organic oxide - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as (3'->5')-dinucleotide phosphorothioates. These are compounds consisting of two ribose moieties connected one 5',3'-phosphomonothioic acid O,O'-diester bond. Each ribose unit is N-linked to a nucleic base or an analogue thereof.
External Descriptors
Not available