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Structure Information
Structure

Compound Identification

SMILES

OC(C=O)=CNC1=NC(=O)C2=C(N1)N=CN2

InChIKey

InChIKey=BQELTNHOTGNIPS-UHFFFAOYSA-N

Formula

C8H7N5O3

Mass

221.176

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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

Aromatic heteropolycyclic compounds

Substituents

6-oxopurine - Hypoxanthine - Aminopyrimidine - Pyrimidone - Pyrimidine - Alpha,beta-unsaturated aldehyde - Azole - Heteroaromatic compound - Enal - Vinylogous amide - Alpha-hydroxyaldehyde - Imidazole - Azacycle - Enamine - Aldehyde - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Amine - 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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