Structure Information
Structure

Compound Identification

SMILES

OC[C@H]1O[C@H](C[C@@H]1O)N1C=NC2C1=NC(NC1=CC=CC(=C1)C(F)(F)F)=NC2=O

InChIKey

InChIKey=IBJFGVYDLOGAQY-VCKSIFHUSA-N

Formula

C17H16F3N5O4

Mass

411.341

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Imidazopyrimidines

Subclass

Purines and purine derivatives

Intermediate Tree Nodes

Purinones

Direct Parent

6-oxopurines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

6-oxopurine - Alpha-amino acid or derivatives - Pentose monosaccharide - Trifluoromethylbenzene - Aniline or substituted anilines - Aminopyrimidine - Pyrimidone - Hydropyrimidine - 5,6-dihydropyrimidine - Pyrimidine - Imidolactam - Monosaccharide - Benzenoid - Monocyclic benzene moiety - 2-imidazoline - Oxolane - N-acylimine - Secondary alcohol - Formamidine - Amidine - Carboxylic acid amidine - Carboxylic acid derivative - Oxacycle - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Organic nitrogen compound - Hydrocarbon derivative - Alkyl halide - Alkyl fluoride - Carbonyl group - Organic oxide - Alcohol - Amine - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Primary alcohol - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 6-oxopurines. These are purines that carry a C=O group at position 6. Purine is a bicyclic aromatic compound made up of a pyrimidine ring fused to an imidazole ring.

External Descriptors

Not available

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