Structure Information
Structure

Compound Identification

SMILES

CC(=O)OCC1OC(OC2=C(C=C(C=C2C)[N+]([O-])=O)[N+]([O-])=O)C(OC(C)=O)C(OC(C)=O)C1OC(C)=O

InChIKey

InChIKey=DJBNKOFZICOBFA-UHFFFAOYSA-N

Formula

C21H24N2O14

Mass

528.423

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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

Phenolic glycosides

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Phenolic glycoside - Dinitrotoluene - Tetracarboxylic acid or derivatives - O-glycosyl compound - Nitrobenzene - Nitrotoluene - Phenoxy compound - Nitroaromatic compound - Phenol ether - Toluene - Monocyclic benzene moiety - Monosaccharide - Oxane - Benzenoid - Carboxylic acid ester - C-nitro compound - Organic nitro compound - Organic 1,3-dipolar compound - Organoheterocyclic compound - Oxacycle - Organic oxoazanium - Acetal - Carboxylic acid derivative - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic nitrogen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Carbonyl group - Organic zwitterion - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as phenolic glycosides. These are organic compounds containing a phenolic structure attached to a glycosyl moiety. Some examples of phenolic structures include lignans, and flavonoids. Among the sugar units found in natural glycosides are D-glucose, L-Fructose, and L rhamnose.

External Descriptors

Not available

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