Structure Information
Structure

Compound Identification

SMILES

NC1=NC(=O)C2=C(N1)N(C=N2)[C@@H]1C[C@H](OCP(O)(=O)OP(O)(=O)C(Br)(Br)P(O)(O)=O)C=C1

InChIKey

InChIKey=KFOMNNQJNYXTAZ-NKWVEPMBSA-N

Formula

C12H16Br2N5O10P3

Mass

643.014

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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 - Bisphosphonate - Aminopyrimidine - Pyrimidone - N-substituted imidazole - Pyrimidine - Azole - Imidazole - Organophosphonic acid - Organophosphonic acid derivative - Heteroaromatic compound - Vinylogous amide - Azacycle - Organonitrogen compound - Organobromide - Amine - Alkyl halide - Organohalogen compound - Hydrocarbon derivative - Alkyl bromide - Organic oxide - Organopnictogen compound - Organic nitrogen compound - Organooxygen compound - Organophosphorus compound - Primary amine - Organic oxygen 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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