Structure Information
Structure

Compound Identification

SMILES

CCC(CO)NCCNC(CC)CO.NCC[C@H](O)C(=O)N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O[C@H]1O[C@H](CO)[C@@H](O)[C@H](N)[C@H]1O.CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C)(O)C[C@@H](C)CN(C)[C@H](C)[C@@H](O)[C@]1(C)O.CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@@](C)(C[C@@H](C)C(=O)[C@H](C)[C@@H](O)[C@]1(C)O)OC

InChIKey

InChIKey=MQRPLPOZIPQRQD-VGWHDUPRSA-N

Formula

C108H208N10O40

Mass

2286.882

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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 - Aminoglycosides - Aminocyclitol glycosides - 2-deoxystreptamine aminoglycosides

Direct Parent

4,6-disubstituted 2-deoxystreptamines

Alternative Parents

Molecular Framework

Not available

Substituents

4,6-disubstituted 2-deoxystreptamine - Macrolide - Gamma amino acid or derivatives - Glycosyl compound - O-glycosyl compound - Aminocyclitol or derivatives - Cyclohexanol - Cyclohexylamine - Cyclitol or derivatives - Fatty acyl - Fatty amide - Oxane - Monosaccharide - N-acyl-amine - Cyclic alcohol - 1,3-aminoalcohol - Tertiary alcohol - 1,2-aminoalcohol - Amino acid or derivatives - Carboxamide group - Carboxylic acid ester - Tertiary aliphatic amine - Tertiary amine - Lactone - Secondary carboxylic acid amide - Secondary alcohol - Polyol - Secondary amine - Monocarboxylic acid or derivatives - Acetal - Carboxylic acid derivative - Oxacycle - Azacycle - Dialkyl ether - Secondary aliphatic amine - Ether - Organoheterocyclic compound - Organic oxide - Alcohol - Hydrocarbon derivative - Primary alcohol - Organonitrogen compound - Primary aliphatic amine - Organopnictogen compound - Carbonyl group - Primary amine - Amine - Organic nitrogen compound - Aliphatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as 4,6-disubstituted 2-deoxystreptamines. These are 2-deoxystreptamine aminoglycosides that a glycosidically linked to a pyranose of furanose unit at the C4- and C6-positions.

External Descriptors

Not available

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