Compound Identification
SMILES
[Na+].[Na+].COP([O-])(=O)OC1OC(C(O)C1O)N1C=NC2=C1NC=NC2=O.COP([O-])(=O)O[C@H]1O[C@H]([C@H](O)[C@@H]1O)N1C=NC2=C1NC=NC2=O
InChIKey
InChIKey=KZTLNLCKMWARDE-WPBKEBEDSA-L
Formula
C20H24N8Na2O16P2
Mass
740.379
Taxonomic Classification
Taxonomy Tree
-
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 Dialkyl phosphates Monosaccharides N-substituted imidazoles Vinylogous amides Oxolanes Heteroaromatic compounds Secondary alcohols Oxacyclic compounds Azacyclic compounds Organic oxides Hydrocarbon derivatives Organic sodium salts Organic zwitterions Organonitrogen compounds Organopnictogen compounds
Molecular Framework
Not available
Substituents
6-oxopurine - Hypoxanthine - Pyrimidone - Dialkyl phosphate - Monosaccharide - N-substituted imidazole - Organic phosphoric acid derivative - Phosphoric acid ester - Pyrimidine - Alkyl phosphate - Azole - Imidazole - Heteroaromatic compound - Oxolane - Vinylogous amide - Secondary alcohol - Organic alkali metal salt - Azacycle - Oxacycle - Organic zwitterion - Organic salt - Organic sodium salt - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Alcohol - Organic nitrogen 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