Structure Information
Structure

Compound Identification

SMILES

CC1=CN([C@H]2C[C@@H]3OP(O)(=O)OC[C@H]4O[C@H](C[C@@H]4OP(O)(=O)OC[C@H]3O2)N2C=NC3=C2NC(N)=NC3=O)C(=O)NC1=O

InChIKey

InChIKey=LJPQTYAZPXGOLZ-PRSXHHODSA-N

Formula

C20H25N7O13P2

Mass

633.404

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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 dinucleotides and analogues

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

(3'->5')-cyclic dinucleotide or analogue - Purine deoxyribonucleoside 3',5'-bisphosphate - Purine deoxyribonucleoside bisphosphate - 6-oxopurine - Hypoxanthine - Imidazopyrimidine - Purine - Pyrimidone - Aminopyrimidine - Pyrimidine - Hydropyrimidine - Organic phosphoric acid derivative - N-substituted imidazole - Vinylogous amide - Heteroaromatic compound - Azole - Oxolane - Imidazole - Urea - Lactam - Organoheterocyclic compound - Oxacycle - Azacycle - Amine - Organic nitrogen compound - Organonitrogen compound - Organic oxygen compound - Organooxygen compound - Primary amine - Organic oxide - Hydrocarbon derivative - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as (3'->5')-cyclic dinucleotides and analogues. These are cyclic compounds consisting of two ribose moieties connected by two 5',3'-phosphodiester bonds to form a cycle. Each ribose unit is N-linked to a nucleic base or an analogue thereof. Some natural (3'->5')-cyclic dinucleotides include c-di-AMP. Synthetic derivatives are generally more elaborated molecules in which one or the two nucleobase moieties, and/or sugar residues, and/or phosphodiester linkers have been modified.

External Descriptors

Not available

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