Structure Information
Structure

Compound Identification

SMILES

CN1N=NC2=C(N=CN2C1=O)C(N)=O.NC1=NC2=C(NC=N2)C(OCC2=CC=CC=C2)=N1

InChIKey

InChIKey=OAJKEGIORKGXPQ-UHFFFAOYSA-N

Formula

C18H17N11O3

Mass

435.408

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Imidazopyrimidines

Subclass

Purines and purine derivatives

Intermediate Tree Nodes

Purinones

Direct Parent

Hypoxanthines

Alternative Parents

Molecular Framework

Not available

Substituents

Hypoxanthine - Imidazotetrazine - 2-heteroaryl carboxamide - Alkyl aryl ether - Aminopyrimidine - Imidazole-4-carbonyl group - Monocyclic benzene moiety - Benzenoid - Tetrazine - Pyrimidine - N-substituted imidazole - Azole - Heteroaromatic compound - Vinylogous amide - Imidazole - Carboxamide group - Primary carboxylic acid amide - Ether - Carboxylic acid derivative - Azacycle - Primary amine - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as hypoxanthines. These are compounds containing the purine derivative 1H-purin-6(9H)-one. Purine is a bicyclic aromatic compound made up of a pyrimidine ring fused to an imidazole ring.

External Descriptors

Not available

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