Structure Information
Structure

Compound Identification

SMILES

CN1C2N=C(N)N(CC(O)COC3=CC=CC(C)=C3)C2C(=O)N(C)C1=O

InChIKey

InChIKey=HAEMYHGIGQVDSS-UHFFFAOYSA-N

Formula

C17H23N5O4

Mass

361.402

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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 - Alpha-amino acid or derivatives - Purinone - Alkaloid or derivatives - Phenoxy compound - Phenol ether - Alkyl aryl ether - Pyrimidone - Toluene - Ureide - N-acyl urea - Monocyclic benzene moiety - 1,3-diazinane - Pyrimidine - Benzenoid - 2-imidazoline - Dicarboximide - Guanidine - Secondary alcohol - Urea - Carbonic acid derivative - Carboxylic acid derivative - Ether - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Alcohol - Organic oxygen compound - Organopnictogen compound - Carbonyl group - Organonitrogen compound - Organooxygen 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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