Compound Identification
SMILES
CC(C)C(=O)NC1=NC(=O)C2=C(N1)N(C=N2)[C@H]1C[C@H](OC(C)=O)[C@@H](CO[P@@](C)(=O)O[C@H]2C[C@@H](O[C@@H]2CO[P@@](C)(=O)O[C@H]2C[C@@H](O[C@@H]2CO)N2C=CC(NC(=O)C3=CC=CC=C3)=NC2=O)N2C=C(C)C(=O)NC2=O)O1
InChIKey
InChIKey=AHCGRXAXJBBVJC-WQXYNXAYSA-N
Formula
C44H54N10O18P2
Mass
1072.916
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
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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 Benzamides N-arylamides Benzoyl derivatives Pyrimidones Dialkyl alkylphosphonates Phosphonic acid esters N-substituted imidazoles Imidolactams Hydropyrimidines Vinylogous amides Tetrahydrofurans Heteroaromatic compounds Ureas Secondary carboxylic acid amides Lactams Carboxylic acid esters Oxacyclic compounds Monocarboxylic acids and derivatives Azacyclic compounds Primary alcohols Organopnictogen compounds Organophosphorus compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Hypoxanthine - 6-oxopurine - Benzoic acid or derivatives - Benzamide - N-arylamide - Benzoyl - Dialkyl alkylphosphonate - Phosphonic acid diester - Pyrimidone - Imidolactam - Benzenoid - Pyrimidine - Phosphonic acid ester - N-substituted imidazole - Hydropyrimidine - Monocyclic benzene moiety - Heteroaromatic compound - Vinylogous amide - Tetrahydrofuran - Organophosphonic acid derivative - Imidazole - Azole - Urea - Secondary carboxylic acid amide - Lactam - Carboxylic acid ester - Carboxamide group - Oxacycle - Azacycle - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Primary alcohol - Organophosphorus compound - Organooxygen compound - Organonitrogen compound - Carbonyl group - Alcohol - 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