Structure Information
Structure

Compound Identification

SMILES

CC1=CC(C)=C(\C=C2\C=CC(CCC(=O)NCC#CC3=CC=C(C=C3)N3[C@@H]([C@@H](CC[C@H](O)C4=CC=C(F)C=C4)C3=O)C3=CC=C(O[C@@H]4O[C@@H]([C@@H](O)[C@H](O)[C@H]4O)C(O)=O)C=C3)=N2)N1B(F)F

InChIKey

InChIKey=BLYPKFHQPIGDES-HBKIBYGASA-N

Formula

C47H46BF3N4O10

Mass

894.71

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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

Fatty acyl glycoside - Fatty acyl glycoside of mono- or disaccharide - Phenolic glycoside - Monobactam - 1-o-glucuronide - O-glucuronide - Glucuronic acid or derivatives - Alkyl glycoside - Hexose monosaccharide - O-glycosyl compound - 1-phenylazetidine - 2-phenylazetidine - Phenol ether - Phenoxy compound - Halobenzene - Fluorobenzene - Beta-hydroxy acid - Substituted pyrrole - Fatty amide - Benzenoid - Monocyclic benzene moiety - Pyran - Hydroxy acid - Aryl halide - Aryl fluoride - Fatty acyl - Oxane - Monosaccharide - Beta-lactam - Tertiary carboxylic acid amide - Pyrrole - Heteroaromatic compound - Azetidine - Carboxamide group - Secondary carboxylic acid amide - Secondary alcohol - Lactam - Ketimine - Acetal - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Oxacycle - Propargyl-type 1,3-dipolar organic compound - Organic metalloid salt - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Polyol - Organonitrogen compound - Organohalogen compound - Aromatic alcohol - Alcohol - Organopnictogen compound - Organofluoride - Organic oxide - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - Imine - 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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