Structure Information
Structure

Compound Identification

SMILES

OCC1OC(SC(CC2=CC=C(O)C=C2)=NOS([O-])(=O)=O)C(O)C(O)C1O

InChIKey

InChIKey=WWBNBPSEKLOHJU-UHFFFAOYSA-M

Formula

C14H18NO10S2

Mass

424.42

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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

Monosaccharides - Hexoses - Glucosinolates

Direct Parent

Alkylglucosinolates

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Alkylglucosinolate - Glycosyl compound - S-glycosyl compound - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Monocyclic benzene moiety - Oxane - Benzenoid - Monothioacetal - Organic sulfuric acid or derivatives - Secondary alcohol - Polyol - Organoheterocyclic compound - Oxacycle - Sulfenyl compound - Alcohol - Primary alcohol - Organosulfur compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organic anion - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as alkylglucosinolates. These are organic compounds containing a glucosinolate moiety that carries an alkyl chain.

External Descriptors

Not available

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