Structure Information
Structure

Compound Identification

SMILES

O=C(OC[C@@H]1O[C@H]([C@H]2OC(=S)O[C@H]12)N1C=NC2=C1NC=NC2=O)C1=CC=CC=C1

InChIKey

InChIKey=XSTDSIXDZMFPQR-YPHNTLSLSA-N

Formula

C18H14N4O6S

Mass

414.39

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Nucleosides, nucleotides, and analogues

Class

Purine nucleosides

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Purine nucleosides

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Purine nucleoside - 6-oxopurine - Hypoxanthine - Benzoate ester - Imidazopyrimidine - Purine - Benzoic acid or derivatives - Benzoyl - Pyrimidone - Monosaccharide - N-substituted imidazole - Monocyclic benzene moiety - Pyrimidine - Thiocarbonic acid diester - Benzenoid - Oxolane - Meta-dioxolane - Heteroaromatic compound - Imidazole - Vinylogous amide - Azole - Carboxylic acid ester - Oxacycle - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as purine nucleosides. These are compounds comprising a purine base attached to a ribosyl or deoxyribosyl moiety.

External Descriptors

Not available

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