Structure Information
Structure

Compound Identification

SMILES

NC1=NC(=O)C2=C(N1)N(C=N2)[C@@H]1O[C@H](COP([O-])(=O)OC(=O)CCCC[C@@H]2CCSS2)[C@@H](O)[C@H]1O

InChIKey

InChIKey=CBFBRENOWPXOON-GDHWZLSQSA-M

Formula

C18H25N5O9PS2

Mass

550.52

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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

Not available

Direct Parent

Purine ribonucleoside monophosphates

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Purine ribonucleoside monophosphate - Pentose phosphate - Pentose-5-phosphate - Lipoic_acid_derivative - Glycosyl compound - N-glycosyl compound - 6-oxopurine - Hypoxanthine - Monosaccharide phosphate - Pentose monosaccharide - Imidazopyrimidine - Purine - Acyl phosphate - Aminopyrimidine - Pyrimidone - Monosaccharide - N-substituted imidazole - Organic phosphoric acid derivative - Phosphoric acid ester - Alkyl phosphate - Pyrimidine - Dithiolane - Tetrahydrofuran - Heteroaromatic compound - Vinylogous amide - 1,2-dithiolane - Azole - Imidazole - Secondary alcohol - Amino acid or derivatives - 1,2-diol - Carboxylic acid salt - Organic disulfide - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Carboxylic acid derivative - Oxacycle - Azacycle - Alcohol - Organic salt - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Carbonyl group - Organonitrogen compound - Organopnictogen compound - Primary amine - Amine - Organooxygen compound - Organic anion - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as purine ribonucleoside monophosphates. These are nucleotides consisting of a purine base linked to a ribose to which one monophosphate group is attached.

External Descriptors

CHEBI:86460 : organophosphate oxoanion

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