Compound Identification
SMILES
CN1C2=C(N(CCNC=[N+]3CCOCC3)C(=N2)N2CCCCC2)C(=O)N(C)C1=O
InChIKey
InChIKey=DGCRTKVDBFCENY-UHFFFAOYSA-O
Formula
C19H30N7O3
Mass
404.494
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 Alkaloids and derivatives Dialkylarylamines Pyrimidones Piperidines Aminoimidazoles N-substituted imidazoles Morpholines Vinylogous amides Heteroaromatic compounds Ureas Lactams Oxacyclic compounds Azacyclic compounds Carboxamidines Dialkyl ethers Carboximidamides Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Xanthine - 6-oxopurine - Purinone - Alkaloid or derivatives - Dialkylarylamine - Pyrimidone - Morpholine - N-substituted imidazole - Oxazinane - Piperidine - Pyrimidine - Aminoimidazole - Imidazole - Heteroaromatic compound - Vinylogous amide - Azole - Lactam - Urea - Carboxylic acid amidine - Amidine - Dialkyl ether - Ether - Oxacycle - Carboximidamide - Azacycle - Hydrocarbon derivative - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Organic oxide - Amine - 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