Structure Information
Structure

Compound Identification

SMILES

C[C@@H](CC1=CC=CC=C1)N(C)CCNC1=NC2=C(N1C)C(=O)N(C)C(=O)N2C.C[C@H](CC1=CC=CC=C1)N(C)CCNC1=NC2=C(N1C)C(=O)N(C)C(=O)N2C

InChIKey

InChIKey=CIWHCNJUIDITNZ-IKFJUQJOSA-N

Formula

C40H56N12O4

Mass

768.968

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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

Not available

Substituents

Xanthine - 6-oxopurine - Amphetamine or derivatives - Purinone - Phenylpropane - Alkaloid or derivatives - Pyrimidone - Aralkylamine - Benzenoid - Aminoimidazole - Monocyclic benzene moiety - Pyrimidine - N-substituted imidazole - Vinylogous amide - Heteroaromatic compound - Azole - Imidazole - Urea - Tertiary aliphatic amine - Tertiary amine - Lactam - Azacycle - Organic oxygen compound - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - 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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