Structure Information
Structure

Compound Identification

SMILES

OCC1OC(C(O)C1O)N1C=C(C#N)C2=C1N=CN1N=CN=C21

InChIKey

InChIKey=UPQHWHRNVWHBTG-UHFFFAOYSA-N

Formula

C13H12N6O4

Mass

316.277

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic oxygen compounds

Class

Organooxygen compounds

Subclass

Carbohydrates and carbohydrate conjugates

Intermediate Tree Nodes

Glycosyl compounds

Direct Parent

Glycosylamines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

N-glycosyl compound - Pentose monosaccharide - Pyrrolo[2,3-d]pyrimidine - Triazolopyrimidine - Pyrrolopyrimidine - Monosaccharide - Pyrimidine - Substituted pyrrole - Azole - Heteroaromatic compound - Oxolane - 1,2,4-triazole - Triazole - Pyrrole - Secondary alcohol - Carbonitrile - Nitrile - Oxacycle - Azacycle - Organoheterocyclic compound - Alcohol - Organonitrogen compound - Organic nitrogen compound - Cyanide - Primary alcohol - Hydrocarbon derivative - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as glycosylamines. These are compounds consisting of an amine with a beta-N-glycosidic bond to a carbohydrate, thus forming a cyclic hemiaminal ether bond (alpha-amino ether).

External Descriptors

Not available

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