Compound Identification
SMILES
CNC(CC(O)=O)C(O)=O.CNC(CC(O)=O)C(O)=O.CCN1CCCC1CNC(=O)C1C(O)CC2(O)CC(O)CC(O)CC(O)CC(O)CC(=O)CC(O)CC(=O)OC(C(C)CCC(O)CC(=O)C3=CC=C(NC)C=C3)C(C)\C=C/C=C/C=C/C=C/C=C/C=C/C=C/C(CC1O2)O[C@@H]1O[C@H](C)[C@@H](O)[C@H]([NH3+])[C@@H]1O
InChIKey
InChIKey=XZBMQWHGTKHDMK-JNICLMBESA-O
Formula
C76H119N6O26
Mass
1532.803
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organic oxygen compounds
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Class
Organooxygen compounds
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Subclass
Carbohydrates and carbohydrate conjugates
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Level 5
Aminosaccharides
- Level 6 Aminoglycosides
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Level 5
Aminosaccharides
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Subclass
Carbohydrates and carbohydrate conjugates
-
Class
Organooxygen compounds
-
Superclass
Organic oxygen compounds
Kingdom
Organic compounds
Superclass
Organic oxygen compounds
Class
Organooxygen compounds
Subclass
Carbohydrates and carbohydrate conjugates
Intermediate Tree Nodes
Aminosaccharides
Direct Parent
Aminoglycosides
Alternative Parents
Aspartic acid and derivatives Macrolides and analogues Alkyl-phenylketones Hexoses Butyrophenones O-glycosyl compounds Alpha amino acids Benzoyl derivatives Phenylalkylamines Aryl alkyl ketones Aniline and substituted anilines Secondary alkylarylamines Beta-hydroxy ketones Dicarboxylic acids and derivatives Fatty acids and conjugates Oxanes N-alkylpyrrolidines Secondary alcohols Hemiacetals Trialkylamines Carboxylic acid esters 1,2-aminoalcohols Lactones Cyclic ketones Amino acids Secondary carboxylic acid amides Polyols Acetals Oxacyclic compounds Azacyclic compounds Dialkylamines Carboxylic acids Monoalkylamines Hydrocarbon derivatives Aldehydes Organopnictogen compounds Organic oxides Organic cations
Molecular Framework
Not available
Substituents
Aminoglycoside core - Aspartic acid or derivatives - Macrolide - Alkyl-phenylketone - Hexose monosaccharide - O-glycosyl compound - Butyrophenone - Glycosyl compound - Alpha-amino acid - Alpha-amino acid or derivatives - Phenylketone - Aryl ketone - Benzoyl - Phenylalkylamine - Aniline or substituted anilines - Aryl alkyl ketone - Secondary aliphatic/aromatic amine - Monocyclic benzene moiety - Benzenoid - Dicarboxylic acid or derivatives - N-alkylpyrrolidine - Fatty acid - Monosaccharide - Beta-hydroxy ketone - Oxane - Pyrrolidine - 1,2-aminoalcohol - Amino acid or derivatives - Amino acid - Carboxamide group - Carboxylic acid ester - Hemiacetal - Cyclic ketone - Ketone - Lactone - Tertiary aliphatic amine - Tertiary amine - Secondary carboxylic acid amide - Secondary alcohol - Oxacycle - Organoheterocyclic compound - Secondary aliphatic amine - Carboxylic acid - Polyol - Carboxylic acid derivative - Secondary amine - Acetal - Azacycle - Primary amine - Organic nitrogen compound - Organopnictogen compound - Amine - Carbonyl group - Organic oxide - Primary aliphatic amine - Alcohol - Hydrocarbon derivative - Organonitrogen compound - Aldehyde - Organic cation - 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
Not available