Structure Information
Structure

Compound Identification

SMILES

OC(=O)c1cccnc1.Oc1nc2[nH]cnc2c(=O)n1O

InChIKey

InChIKey=ONCAKHOFAODJIF-UHFFFAOYSA-N

Formula

C11H9N5O5

Mass

291.223

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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 - Purinone - 6-oxopurine - Alkaloid or derivatives - Pyridine carboxylic acid or derivatives - Pyridine carboxylic acid - Pyrimidone - Pyrimidine - Pyridine - Heteroaromatic compound - Vinylogous amide - Imidazole - Azole - Lactam - Azacycle - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - 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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