Structure Information
Structure

Compound Identification

SMILES

CO[C@@H]1[C@@H](O)[C@H](C)O[C@@H](OC2=C(Br)C(C)=C(C(=O)S[C@H]3[C@@H](O)C[C@H](ONC4[C@@H](C)O[C@@H](O[C@H]5C#C\C=C/C#C[C@]6(O)CC(=O)C(NC(=O)OC)=C5\C6=C\CSSSC)[C@H](O)[C@H]4O)O[C@@H]3C)C(OC)=C2OC)[C@@H]1O

InChIKey

InChIKey=YLPNZFRQGMENKS-NYTHOTATSA-N

Formula

C47H59BrN2O19S4

Mass

1164.13

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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 heteropolycyclic compounds

Substituents

Phenolic glycoside - O-glycosyl compound - Halobenzoic acid or derivatives - 3-halobenzoic acid or derivatives - Dimethoxybenzene - O-dimethoxybenzene - Benzoic acid or derivatives - Thiobenzoic acid or derivatives - Methoxybenzene - Anisole - Phenoxy compound - Phenol ether - Benzoyl - Halobenzene - Bromobenzene - Alkyl aryl ether - Toluene - Cyclohexenone - Oxane - Aryl bromide - Aryl halide - Ynone - Monosaccharide - Benzenoid - Monocyclic benzene moiety - Organic trisulfide - Methylcarbamate - Tertiary alcohol - Carbamic acid ester - Carbothioic s-ester - Cyclic ketone - Ketone - Thiocarboxylic acid ester - Secondary alcohol - Thiocarboxylic acid or derivatives - Oxacycle - N-organohydroxylamine - Organoheterocyclic compound - Acetal - Carboxylic acid derivative - Dialkyl ether - Ether - Sulfenyl compound - Organopnictogen compound - Organobromide - Organonitrogen compound - Carbonyl group - Organic oxide - Hydrocarbon derivative - Alcohol - Aldehyde - Organosulfur compound - Organic nitrogen compound - Organohalogen compound - Aromatic heteropolycyclic 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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