Compound Identification
SMILES
[2H]C1=NC2=C(N=CN=C2N)N1CCCCN1C(=O)N(C)C2=C(N(C)C=N2)C1=O
InChIKey
InChIKey=GZPGOEFNZMMJRC-QOWOAITPSA-N
Formula
C16H19N9O2
Mass
370.395
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
- Level 5 Xanthines
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Subclass
Purines and purine derivatives
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Class
Imidazopyrimidines
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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
6-aminopurines 6-oxopurines Alkaloids and derivatives Pyrimidones Aminopyrimidines and derivatives N-substituted imidazoles Imidolactams Vinylogous amides Heteroaromatic compounds Ureas Lactams Azacyclic compounds Hydrocarbon derivatives Organic oxides Organooxygen compounds Primary amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Xanthine - 6-aminopurine - 6-oxopurine - Purinone - Alkaloid or derivatives - Aminopyrimidine - Pyrimidone - N-substituted imidazole - Pyrimidine - Imidolactam - Heteroaromatic compound - Imidazole - Azole - Vinylogous amide - Urea - Lactam - Azacycle - Organic oxygen compound - Hydrocarbon derivative - Primary amine - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Organic oxide - Amine - 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