Compound Identification
SMILES
C[C@H](CN1C(Br)NC2=C1NC(N)=NC2=O)OCP(O)(O)=O
InChIKey
InChIKey=AOXUTPPKHNPZPN-WZIMWHJTSA-N
Formula
C9H15BrN5O5P
Mass
384.127
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
- Level 5 Purinones
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Subclass
Purines and purine derivatives
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Class
Imidazopyrimidines
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Imidazopyrimidines
Subclass
Purines and purine derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Purinones
Alternative Parents
Dialkylarylamines Secondary alkylarylamines Pyrimidones Aminopyrimidines and derivatives Vinylogous amides Organic phosphonic acids Heteroaromatic compounds Azacyclic compounds Primary amines Organophosphorus compounds Organooxygen compounds Organobromides Organic oxides Hydrocarbon derivatives Alkyl bromides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Purinone - Dialkylarylamine - Aminopyrimidine - Pyrimidone - Secondary aliphatic/aromatic amine - Pyrimidine - Organophosphonic acid - Organophosphonic acid derivative - Heteroaromatic compound - Vinylogous amide - Tertiary amine - Azacycle - Secondary amine - Amine - Organic oxygen compound - Primary amine - Organophosphorus compound - Organooxygen compound - Organonitrogen compound - Organobromide - Alkyl halide - Alkyl bromide - Organohalogen compound - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as purinones. These are purines in which the purine moiety bears a C=O group. Purine is a bicyclic aromatic compound made up of a pyrimidine ring fused to an imidazole ring.
External Descriptors
Not available