Compound Identification
SMILES
CN1C2=C(N(CC=C(C)C)C(=N2)N2CCCC(N)C2)C(=O)N(CC2=CC3=CC=CC=C3C=N2)C1=O
InChIKey
InChIKey=FGTKMQSYRXSEMR-UHFFFAOYSA-N
Formula
C26H31N7O2
Mass
473.581
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-oxopurines Isoquinolines and derivatives Alkaloids and derivatives Dialkylarylamines Pyrimidones Aminopiperidines Pyridines and derivatives N-substituted imidazoles Aminoimidazoles Benzenoids Vinylogous amides Heteroaromatic compounds Ureas Lactams Azacyclic compounds Hydrocarbon derivatives Monoalkylamines Organic oxides Organooxygen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Xanthine - 6-oxopurine - Isoquinoline - Purinone - Alkaloid or derivatives - Dialkylarylamine - 3-aminopiperidine - Pyrimidone - N-substituted imidazole - Piperidine - Benzenoid - Aminoimidazole - Pyridine - Pyrimidine - Heteroaromatic compound - Azole - Imidazole - Vinylogous amide - Lactam - Urea - Azacycle - Organooxygen compound - Organonitrogen compound - Primary aliphatic amine - Amine - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Primary amine - Organic nitrogen compound - 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