Structure Information
Structure

Compound Identification

SMILES

NC1=NC=NC2=C1N=CN2[C@@H]1OC(COP(O)(=O)OC(=O)C2CS\C(N2)=C2/SC3=CC(=O)C=CC3=N2)[C@@H](O)[C@H]1O

InChIKey

InChIKey=PASQPRDQIXHMST-RUXKSGDKSA-N

Formula

C21H20N7O9PS2

Mass

609.52

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Nucleosides, nucleotides, and analogues

Class

Purine nucleotides

Subclass

Purine ribonucleotides

Intermediate Tree Nodes

Purine ribonucleoside monophosphates

Direct Parent

5'-acylphosphoadenosines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

5'-acylphosphoadenosine - Pentose phosphate - Pentose-5-phosphate - Glycosyl compound - N-glycosyl compound - 6-aminopurine - Alpha-amino acid or derivatives - Monosaccharide phosphate - Pentose monosaccharide - Imidazopyrimidine - Purine - Acyl phosphate - Aminopyrimidine - Monoalkyl phosphate - Monosaccharide - N-substituted imidazole - Pyrimidine - Organic phosphoric acid derivative - Alkyl phosphate - Phosphoric acid ester - Imidolactam - Heteroaromatic compound - Imidazole - Thiazole - Azole - Oxolane - Thiazolidine - Ketone - Amino acid or derivatives - Secondary alcohol - Cyclic ketone - 1,2-diol - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Oxacycle - Monocarboxylic acid or derivatives - Carbonyl group - Organonitrogen compound - Organic nitrogen compound - Organooxygen compound - Amine - Primary amine - Organic oxide - Hydrocarbon derivative - Alcohol - Organic oxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 5'-acylphosphoadenosines. These are ribonucleoside derivatives containing an adenoside moiety, where the phosphate group is acylated.

External Descriptors

Not available

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