Compound Identification
SMILES
[B][P+]1(O)OC[C@H]2O[C@H](C(O)[C@@H]2O1)N1C=NC2=C1NC(=O)NC2=O
InChIKey
InChIKey=ZQTGFCCGRGBQNX-UVIVQKFQSA-O
Formula
C10H11BN4O7P
Mass
341.0
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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Class
Imidazopyrimidines
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Subclass
Purines and purine derivatives
- Level 5 Xanthines
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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
Not available
Direct Parent
Xanthines
Alternative Parents
Glycosylamines 6-oxopurines Alkaloids and derivatives Pyrimidones N-substituted imidazoles Monosaccharides Vinylogous amides Oxolanes Heteroaromatic compounds Ureas Secondary alcohols Lactams Oxacyclic compounds Azacyclic compounds Organic metalloid salts Organic oxides Organonitrogen compounds Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Glycosyl compound - N-glycosyl compound - Xanthine - 6-oxopurine - Purinone - Alkaloid or derivatives - Pyrimidone - Pyrimidine - Monosaccharide - N-substituted imidazole - Vinylogous amide - Heteroaromatic compound - Azole - Imidazole - Oxolane - Urea - Secondary alcohol - Lactam - Oxacycle - Organic metalloid salt - Azacycle - Alcohol - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as xanthines. These are purine derivatives with a ketone group conjugated at carbons 2 and 6 of the purine moiety.
External Descriptors
Not available