Compound Identification
SMILES
CCOP(=O)(CC[C@H](COC(=O)C1=CC=CC=C1)OCN1C=NC2=C1NC(N)=NC2=O)OCC
InChIKey
InChIKey=YAQNTYIRRUQFPP-MRXNPFEDSA-N
Formula
C21H28N5O7P
Mass
493.457
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 Benzoic acid esters Benzoyl derivatives Pyrimidones Aminopyrimidines and derivatives Dialkyl alkylphosphonates Phosphonic acid esters N-substituted imidazoles Vinylogous amides Heteroaromatic compounds Amino acids and derivatives Carboxylic acid esters Azacyclic compounds Hydrocarbon derivatives Organic oxides Organooxygen compounds Organophosphorus compounds Primary amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
6-oxopurine - Benzoate ester - Hypoxanthine - Benzoic acid or derivatives - Benzoyl - Aminopyrimidine - Dialkyl alkylphosphonate - Phosphonic acid diester - Pyrimidone - Monocyclic benzene moiety - Benzenoid - Pyrimidine - N-substituted imidazole - Phosphonic acid ester - Azole - Heteroaromatic compound - Vinylogous amide - Imidazole - Organophosphonic acid derivative - Amino acid or derivatives - Carboxylic acid ester - Carboxylic acid derivative - Azacycle - Organic oxygen compound - Amine - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Primary amine - Organonitrogen compound - Organooxygen compound - Organophosphorus 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