Structure Information
Structure

Compound Identification

SMILES

CN1C2=C(N(CC=C(C)C)C(=N2)N2CCCC(N)C2)C(=O)N(CC(=O)C2=C3CCCC3=CC=C2)C1=O

InChIKey

InChIKey=FLKJCCKPPMKGIC-UHFFFAOYSA-N

Formula

C27H34N6O3

Mass

490.608

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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 - Indane - Alkaloid or derivatives - Dialkylarylamine - Aryl alkyl ketone - Aryl ketone - 3-aminopiperidine - Pyrimidone - Aminoimidazole - N-substituted imidazole - Piperidine - Benzenoid - Pyrimidine - Azole - Imidazole - Heteroaromatic compound - Vinylogous amide - Lactam - Ketone - Urea - Azacycle - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Primary aliphatic amine - Hydrocarbon derivative - Amine - Organic nitrogen compound - Primary amine - Organic oxide - 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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