Structure Information
Structure

Compound Identification

SMILES

NC1=NC(=O)N(C=C1)[C@H]1C[C@@H]2OP(O)(=S)OC[C@H]3O[C@H](C[C@@H]3OP(O)(=O)OC[C@H]2O1)N1C=NC2=C(N)N=CN=C12

InChIKey

InChIKey=JPGHKLAAXHZGBI-LPNCVYLNSA-N

Formula

C19H24N8O10P2S

Mass

618.45

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Nucleosides, nucleotides, and analogues

Class

(3'->5')-dinucleotides and analogues

Subclass

(3'->5')-cyclic dinucleotides and analogues

Intermediate Tree Nodes

Not available

Direct Parent

(3'->5')-cyclic dinucleotide phosphoromonothioate analogues

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

(3'->5')-cyclic dinucleotide phosphoromonothioate analogue - 6-aminopurine - Purine - Imidazopyrimidine - Thiophosphate diester - Pyrimidone - Aminopyrimidine - Imidolactam - Organic thiophosphoric acid or derivatives - Pyrimidine - Thiophosphoric acid ester - Organic phosphoric acid derivative - N-substituted imidazole - Hydropyrimidine - Heteroaromatic compound - Tetrahydrofuran - Imidazole - Azole - Oxacycle - Azacycle - Organoheterocyclic compound - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Primary amine - Organooxygen compound - Organonitrogen compound - Amine - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as (3'->5')-cyclic dinucleotide phosphoromonothioate analogues. These are cyclic compounds consisting of two ribose moieties connected one 5',3'-phosphomonothioic acid O,O'-diester bond and one phosphodiester bond, to form a cycle. Each ribose unit is N-linked to a nucleic base or an analogue thereof.

External Descriptors

Not available

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