Compound Identification
SMILES
[O-]P([O-])([O-])=O.[O-]P([O-])([O-])=O.CC(C)=C(O)C(O)CO.NC1=NC(=O)C2=C(N1)N(COCCO)C=N2
InChIKey
InChIKey=UORAFWCUUJKPHJ-UHFFFAOYSA-H
Formula
C14H23N5O14P2
Mass
547.31
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
-
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 Pyrimidones Aminopyrimidines and derivatives Organic phosphoric acids and derivatives N-substituted imidazoles Vinylogous amides Heteroaromatic compounds Secondary alcohols 1,2-diols Azacyclic compounds Enols Primary amines Hydrocarbon derivatives Organic oxides Primary alcohols Organic anions
Molecular Framework
Not available
Substituents
6-oxopurine - Hypoxanthine - Aminopyrimidine - Pyrimidone - Pyrimidine - N-substituted imidazole - Organic phosphoric acid derivative - Azole - Heteroaromatic compound - Vinylogous amide - Imidazole - 1,2-diol - Secondary alcohol - Enol - Azacycle - Polyol - Primary alcohol - Primary amine - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Amine - Organonitrogen compound - Organooxygen compound - Alcohol - Organic anion - 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