Structure Information
Structure

Compound Identification

SMILES

[Na].[O-]C(=O)c1ccccc1.Cn1cnc2n(C)c(=O)n(C)c(=O)c12

InChIKey

InChIKey=WKDXHXLJUHINND-UHFFFAOYSA-M

Formula

C15H15N4NaO4

Mass

338.299

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Imidazopyrimidines

Subclass

Purines and purine derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Xanthines

Alternative Parents

Molecular Framework

Not available

Substituents

Xanthine - 6-oxopurine - Purinone - Benzoic acid or derivatives - Benzoic acid - Alkaloid or derivatives - Benzoyl - Pyrimidone - Monocyclic benzene moiety - N-substituted imidazole - Benzenoid - Pyrimidine - Azole - Heteroaromatic compound - Imidazole - Vinylogous amide - Carboxylic acid salt - Lactam - Urea - Monocarboxylic acid or derivatives - Organic alkali metal salt - Carboxylic acid - Carboxylic acid derivative - Azacycle - Organonitrogen compound - Organic salt - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organooxygen compound - Organic oxygen compound - Organic anion - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as xanthines. These are purine derivatives with a ketone group conjugated at carbons 2 and 6 of the purine moiety.

External Descriptors

Not available

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