Structure Information
Structure

Compound Identification

SMILES

OCC1OC(C(O)C1O)N1C=NC23OC12N=C(O)N=C3O

InChIKey

InChIKey=FMUSHVVGYGXRCD-UHFFFAOYSA-N

Formula

C10H12N4O7

Mass

300.227

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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

Aliphatic heteropolycyclic compounds

Substituents

Glycosyl compound - N-glycosyl compound - Xanthine - Pentose monosaccharide - Alkaloid or derivatives - Hydropyrimidine - 5,6-dihydropyrimidine - Monosaccharide - Tetrahydrofuran - 2-imidazoline - Secondary alcohol - Orthocarboxylic acid derivative - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Oxacycle - Azacycle - Carboxylic acid amidine - Oxirane - Formamidine - Amidine - Organopnictogen compound - Alcohol - Organonitrogen compound - Organic nitrogen compound - Organooxygen compound - Organic oxygen compound - Hydrocarbon derivative - Primary alcohol - Aliphatic 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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