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
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Nucleosides, nucleotides, and analogues
- Class Purine nucleosides
-
Superclass
Nucleosides, nucleotides, and analogues
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
6-oxopurines Benzoic acid esters Hypoxanthines Benzoyl derivatives Pyrimidones Thiocarbonic acid diesters Monosaccharides N-substituted imidazoles Vinylogous amides Heteroaromatic compounds Oxolanes 1,3-dioxolanes Carboxylic acid esters Oxacyclic compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides Organonitrogen compounds
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