Compound Identification
SMILES
CC[C@@H](CO)NCCN[C@@H](CC)CO.OC(=O)C1=CN(C2CC2)C2=CC(N3CCNCC3)=C(F)C=C2C1=O.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(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
InChIKey
InChIKey=DMMKNMFWEFEUTE-GWQBIPJSSA-N
Formula
C87H157FN12O30
Mass
1870.265
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
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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
4,6-disubstituted 2-deoxystreptamines
Alternative Parents
Quinoline carboxylic acids Fluoroquinolones Gamma amino acids and derivatives N-arylpiperazines Haloquinolines Aminoquinolines and derivatives Hydroquinolones O-glycosyl compounds Hydroquinolines Pyridinecarboxylic acids Aminocyclitols and derivatives Dialkylarylamines Cyclohexanols Cyclohexylamines Aryl fluorides Oxanes N-acyl amines Monosaccharides Benzenoids Heteroaromatic compounds Vinylogous amides 1,3-aminoalcohols Amino acids 1,2-aminoalcohols Secondary carboxylic acid amides Dialkylamines Monocarboxylic acids and derivatives Acetals Carboxylic acids Oxacyclic compounds Polyols Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Monoalkylamines Organic oxides Organofluorides Organopnictogen compounds Primary alcohols
Molecular Framework
Not available
Substituents
4,6-disubstituted 2-deoxystreptamine - Quinoline-3-carboxylic acid - Gamma amino acid or derivatives - Fluoroquinolone - N-arylpiperazine - O-glycosyl compound - Dihydroquinolone - Haloquinoline - Aminoquinoline - Glycosyl compound - Dihydroquinoline - Quinoline - Pyridine carboxylic acid - Pyridine carboxylic acid or derivatives - Aminocyclitol or derivatives - Dialkylarylamine - Tertiary aliphatic/aromatic amine - Cyclohexylamine - Cyclohexanol - Benzenoid - Monosaccharide - Oxane - Piperazine - Fatty amide - 1,4-diazinane - N-acyl-amine - Fatty acyl - Pyridine - Aryl halide - Aryl fluoride - Cyclitol or derivatives - Heteroaromatic compound - Vinylogous amide - Cyclic alcohol - 1,3-aminoalcohol - 1,2-aminoalcohol - Amino acid or derivatives - Amino acid - Carboxamide group - Tertiary amine - Secondary carboxylic acid amide - Secondary alcohol - Monocarboxylic acid or derivatives - Polyol - Secondary amine - Acetal - Secondary aliphatic amine - Oxacycle - Organoheterocyclic compound - Azacycle - Carboxylic acid - Carboxylic acid derivative - Organohalogen compound - Alcohol - Carbonyl group - Amine - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Primary alcohol - Organopnictogen compound - Organonitrogen compound - Primary aliphatic amine - Primary amine - Organofluoride - Aromatic heteropolycyclic 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