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
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Imidazopyrimidines
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Subclass
Purines and purine derivatives
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Level 5
Purinones
- Level 6 Hypoxanthines
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Level 5
Purinones
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Subclass
Purines and purine derivatives
-
Class
Imidazopyrimidines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Imidazopyrimidines
Subclass
Purines and purine derivatives
Intermediate Tree Nodes
Purinones
Direct Parent
Hypoxanthines
Alternative Parents
6-oxopurines Bisphosphonates Pyrimidones Aminopyrimidines and derivatives N-substituted imidazoles Vinylogous amides Heteroaromatic compounds Organic phosphonic acids Azacyclic compounds Organic oxides Hydrocarbon derivatives Organobromides Organooxygen compounds Organophosphorus compounds Organopnictogen compounds Alkyl bromides Primary amines
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