Compound Identification
SMILES
CCCN1C2=C(N\C(N2)=C2/C=C(O)C=CC2=O)C(=O)N(CCC)C1=O
InChIKey
InChIKey=WMIPDIZVMKVDNL-KAMYIIQDSA-N
Formula
C17H20N4O4
Mass
344.371
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
Purinones Alkaloids and derivatives O-quinomethanes Pyrimidones Vinylogous amides Heteroaromatic compounds Ureas Lactams Ketene acetals Enols Azacyclic compounds Organic oxides Hydrocarbon derivatives Amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Xanthine - Purinone - Alkaloid or derivatives - O-quinomethane - Quinomethane - Pyrimidone - Pyrimidine - Heteroaromatic compound - Vinylogous amide - Cyclic ketone - Urea - Ketene acetal or derivatives - Ketone - Lactam - Azacycle - Enol - Hydrocarbon derivative - Organonitrogen compound - Organic nitrogen compound - Organooxygen compound - Organic oxygen compound - Amine - Organic oxide - Carbonyl group - 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