Structure Information
Structure

Compound Identification

SMILES

CO[C@H]1[C@H](O)CC(=O)O[C@H](C)C\C=C\C=C\[C@H](O[C@H]2CC[C@@H](C(C)O2)N(C)C)[C@H](C)C[C@H](CC=O)[C@@H]1O[C@@H]1O[C@H](C)[C@@H](O[C@H]2CC(C)(O)[C@@H](O)[C@@H](C)O2)C(C1C)N(C)C

InChIKey

InChIKey=HQKJVXPZSGRXCT-NUFLVFHKSA-N

Formula

C44H76N2O13

Mass

841.093

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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

Aliphatic heteromonocyclic compounds

Substituents

Aminoglycoside core - Macrolide - Disaccharide - Glycosyl compound - O-glycosyl compound - Oxane - Alpha-hydrogen aldehyde - Tertiary alcohol - Tertiary aliphatic amine - Secondary alcohol - Tertiary amine - Lactone - Amino acid or derivatives - Carboxylic acid ester - Organoheterocyclic compound - Oxacycle - Monocarboxylic acid or derivatives - Acetal - Ether - Carboxylic acid derivative - Dialkyl ether - Alcohol - Organopnictogen compound - Carbonyl group - Organic nitrogen compound - Organic oxide - Amine - Hydrocarbon derivative - Aldehyde - Organonitrogen compound - Aliphatic heteromonocyclic 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

LIPIDMAPS (LMPK04000005) : Macrolides and lactone polyketides

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