Structure Information
Structure

Compound Identification

SMILES

N#CCCS[C@@H]1O[C@H](COCC2=CC=CC=C2)[C@@H](OCC2=CC=CC=C2)[C@H](OCC2=CC=CC=C2)[C@H]1OCC1=CC=CC=C1

InChIKey

InChIKey=NXKJOSMXHQAHFY-MANRWTMFSA-N

Formula

C37H39NO5S

Mass

609.78

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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

Cyanogenic glycosides

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Cyanogenic glycoside - Hexose monosaccharide - S-glycosyl compound - Benzylether - Monocyclic benzene moiety - Monosaccharide - Benzenoid - Oxane - Monothioacetal - Dialkyl ether - Ether - Oxacycle - Organoheterocyclic compound - Sulfenyl compound - Carbonitrile - Nitrile - Hydrocarbon derivative - Organic nitrogen compound - Cyanide - Organonitrogen compound - Organosulfur compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as cyanogenic glycosides. These are glycosides in which the aglycone moiety contains a cyanide group.

External Descriptors

Not available

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