Structure Information
Structure

Compound Identification

SMILES

OC[C@H]1O[C@@H](O[C@@]2(CCC=C2)C#N)[C@H](O)[C@@H](O)[C@H]1O

InChIKey

InChIKey=HBCFZAXOSTUEHA-QUHKTUSISA-N

Formula

C12H17NO6

Mass

271.269

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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

Hexoses O-glycosyl compounds Oxanes Secondary alcohols Polyols Oxacyclic compounds Nitriles Acetals Primary alcohols Organopnictogen compounds Hydrocarbon derivatives

Molecular Framework

Aliphatic heteromonocyclic compounds

Substituents

Cyanogenic glycoside - Hexose monosaccharide - O-glycosyl compound - Monosaccharide - Oxane - Secondary alcohol - Organoheterocyclic compound - Polyol - Nitrile - Carbonitrile - Acetal - Oxacycle - Primary alcohol - Alcohol - Organonitrogen compound - Cyanide - Organopnictogen compound - Organic nitrogen compound - Hydrocarbon derivative - Aliphatic 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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