Compound Identification
SMILES
NCC[C@H](O)C(=O)N[C@@H]1CC(N)[C@@H](O[C@H]2OC(CN)[C@@H](O)C(Cl)C2N)C(O[C@@H]2O[C@H](CO)C(O)C2O)C1O
InChIKey
InChIKey=KXABYAGBCBXNPZ-ODAPNGSQSA-N
Formula
C21H40ClN5O11
Mass
574.03
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
-
Class
Organooxygen compounds
-
Subclass
Carbohydrates and carbohydrate conjugates
-
Level 5
Aminosaccharides
-
Level 6
Aminoglycosides
- Level 7 Aminocyclitol glycosides
-
Level 6
Aminoglycosides
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Level 5
Aminosaccharides
-
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 - Aminoglycosides - Aminocyclitol glycosides - 2-deoxystreptamine aminoglycosides
Direct Parent
4,5-disubstituted 2-deoxystreptamines
Alternative Parents
Gamma amino acids and derivatives O-glycosyl compounds Aminocyclitols and derivatives Cyclohexanols Cyclohexylamines Oxanes Monosaccharides N-acyl amines Tetrahydrofurans 1,3-aminoalcohols Secondary carboxylic acid amides Chlorohydrins Oxacyclic compounds Acetals Hydrocarbon derivatives Organochlorides Organopnictogen compounds Carbonyl compounds Primary alcohols Alkyl chlorides Monoalkylamines Organic oxides
Molecular Framework
Aliphatic heteromonocyclic compounds
Substituents
4,5-disubstituted 2-deoxystreptamine - Gamma amino acid or derivatives - Glycosyl compound - O-glycosyl compound - Aminocyclitol or derivatives - Cyclohexylamine - Cyclohexanol - Fatty amide - Fatty acyl - Monosaccharide - Cyclitol or derivatives - N-acyl-amine - Oxane - 1,3-aminoalcohol - Tetrahydrofuran - Cyclic alcohol - Amino acid or derivatives - Halohydrin - Secondary carboxylic acid amide - Secondary alcohol - Chlorohydrin - Carboxamide group - Organoheterocyclic compound - Acetal - Carboxylic acid derivative - Oxacycle - Organic nitrogen compound - Primary aliphatic amine - Organohalogen compound - Organochloride - Organonitrogen compound - Primary alcohol - Carbonyl group - Primary amine - Hydrocarbon derivative - Organic oxide - Amine - Alkyl halide - Alkyl chloride - Alcohol - Organopnictogen compound - Aliphatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as 4,5-disubstituted 2-deoxystreptamines. These are 2-deoxystreptamine aminoglycosides that a glycosidically linked to a pyranose of furanose unit at the C4- and C5-positions.
External Descriptors
Not available