Structure Information
Structure

Compound Identification

SMILES

CN1C2=C(N(C=N2)C2OC(COCCCCCC(O)=O)C=CC2=O)C(=O)N(C)C1=O

InChIKey

InChIKey=WBELNQZCEQDSNW-UHFFFAOYSA-N

Formula

C19H24N4O7

Mass

420.422

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Imidazopyrimidines

Subclass

Purines and purine derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Xanthines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Xanthine - 6-oxopurine - Purinone - Alkaloid or derivatives - Medium-chain fatty acid - Amino fatty acid - Dihydropyranone - Heterocyclic fatty acid - Pyrimidone - N-substituted imidazole - Pyran - Pyrimidine - Fatty acyl - Vinylogous amide - Azole - Heteroaromatic compound - Imidazole - Urea - Cyclic ketone - Ketone - Lactam - Oxacycle - Azacycle - Carboxylic acid derivative - Carboxylic acid - Dialkyl ether - Ether - Monocarboxylic acid or derivatives - Carbonyl group - Organic oxide - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - 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

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