Compound Identification
SMILES
CCN(CC)C(=S)SSC(=S)N(CC)CC.C[C@H]1O[C@@H](O[C@@H]2C[C@@H]3O[C@@](O)(C[C@H](O)[C@H]3C(O)=O)C[C@@H](O)C[C@@H](O)[C@H](O)CC[C@@H](O)C[C@@H](O)CC(=O)O[C@@H](C)[C@H](C)[C@H](O)[C@@H](C)\C=C\C=C\C=C\C=C\C=C\C=C\C=C\2)[C@@H](O)[C@@H](N)[C@@H]1O
InChIKey
InChIKey=KELMZNNJKIRSOK-OCOINPOZSA-N
Formula
C57H93N3O17S4
Mass
1220.62
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
Macrolides and analogues Hexoses O-glycosyl compounds Thiuram disulfides Beta hydroxy acids and derivatives Oxanes Dicarboxylic acids and derivatives 1,2-aminoalcohols Secondary alcohols Amino acids Carboxylic acid esters Organic disulfides Hemiacetals Lactones Sulfenyl compounds Acetals Polyols Oxacyclic compounds Carboxylic acids Organopnictogen compounds Carbonyl compounds Organic oxides Monoalkylamines Hydrocarbon derivatives
Molecular Framework
Not available
Substituents
Aminoglycoside core - Macrolide - Hexose monosaccharide - O-glycosyl compound - Glycosyl compound - Thiuram disulfide - Beta-hydroxy acid - Monosaccharide - Hydroxy acid - Dicarboxylic acid or derivatives - Oxane - Hemiacetal - Secondary alcohol - Carboxylic acid ester - Lactone - Organic disulfide - Amino acid - Amino acid or derivatives - 1,2-aminoalcohol - Acetal - Carboxylic acid derivative - Oxacycle - Carboxylic acid - Organoheterocyclic compound - Sulfenyl compound - Polyol - Alcohol - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Amine - Organopnictogen compound - Primary amine - Organic oxide - Organosulfur compound - Organonitrogen compound - Primary aliphatic amine - Aliphatic 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