Structure Information
Structure

Compound Identification

SMILES

COC1=CC2=C(NC(=O)C(=C)O2)C(=C1)C(=O)O[C@H]1COC(=O)C[C@H](N)C2=CC(O)=C(O[C@@H]3C#CC=C1C#CC1=CC=C[C@]31OC1OC(C)(C)C(C(O)C1O)N(C)C)C(Cl)=C2

InChIKey

InChIKey=DGGZCXUXASNDAC-VXNBTGQKSA-N

Formula

C43H42ClN3O13

Mass

844.27

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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

Aminosaccharides

Direct Parent

Aminoglycosides

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Aminoglycoside core - Macrolide - Hexose monosaccharide - Benzoxazinone - M-methoxybenzoic acid or derivatives - Benzomorpholine - Benzoxazine - Anisole - Alkyl aryl ether - Aralkylamine - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Aryl chloride - Aryl halide - Dicarboxylic acid or derivatives - Benzenoid - Monosaccharide - Oxane - Oxazinane - Vinylogous amide - 1,2-diol - Tertiary aliphatic amine - 1,2-aminoalcohol - Carboxamide group - Carboxylic acid ester - Lactam - Tertiary amine - Secondary carboxylic acid amide - Secondary alcohol - Amino acid or derivatives - Lactone - Organoheterocyclic compound - Ether - Oxacycle - Azacycle - Carboxylic acid derivative - Acetal - Organonitrogen compound - Carbonyl group - Alcohol - Hydrocarbon derivative - Organopnictogen compound - Organic nitrogen compound - Amine - Organic oxide - Primary amine - Primary aliphatic amine - Organohalogen compound - Organochloride - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as aminoglycosides. These are molecules or a portion of a molecule composed of amino-modified sugars.

External Descriptors

CHEBI:3252 : macrolide

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