Compound Identification
SMILES
CCC(CO)NCCNC(CC)CO.OC(=O)C1=CN(C2CC2)C2=CC(N3CCNCC3)=C(F)C=C2C1=O.CC(C)N=C1C=C2N(C3=CC=C(Cl)C=C3)C3=CC=CC=C3N=C2C=C1NC1=CC=C(Cl)C=C1.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
InChIKey
InChIKey=IPCOJJILGWPNQL-CVPDNNKYSA-N
Formula
C76H107Cl2FN14O18
Mass
1594.67
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
Phenazines and derivatives Quinoline carboxylic acids Fluoroquinolones Gamma amino acids and derivatives N-arylpiperazines Haloquinolines Hydroquinolones O-glycosyl compounds Aminoquinolines and derivatives Hydroquinolines Pyridinecarboxylic acids Aminocyclitols and derivatives Dialkylarylamines Cyclohexylamines Cyclohexanols Monosaccharides Benzenoids Aryl fluorides Oxanes N-acyl amines Vinylogous amides 1,3-aminoalcohols Heteroaromatic compounds 1,2-aminoalcohols Amino acids Secondary carboxylic acid amides Polyols Acetals Oxacyclic compounds Azacyclic compounds Monocarboxylic acids and derivatives Carboxylic acids Dialkylamines Primary alcohols Organopnictogen compounds Carbonyl compounds Organofluorides Monoalkylamines Hydrocarbon derivatives Organic oxides
Molecular Framework
Not available
Substituents
4,6-disubstituted 2-deoxystreptamine - Phenazine - Quinoline-3-carboxylic acid - Gamma amino acid or derivatives - N-arylpiperazine - Fluoroquinolone - Haloquinoline - Aminoquinoline - Glycosyl compound - O-glycosyl compound - Dihydroquinolone - Dihydroquinoline - Quinoline - Pyridine carboxylic acid - Pyridine carboxylic acid or derivatives - Aminocyclitol or derivatives - Dialkylarylamine - Tertiary aliphatic/aromatic amine - Cyclohexanol - Cyclohexylamine - Fatty acyl - 1,4-diazinane - Cyclitol or derivatives - Pyridine - Oxane - Aryl halide - Monosaccharide - N-acyl-amine - Aryl fluoride - Piperazine - Fatty amide - Benzenoid - 1,3-aminoalcohol - Cyclic alcohol - Heteroaromatic compound - Vinylogous amide - 1,2-aminoalcohol - Carboxamide group - Tertiary amine - Secondary carboxylic acid amide - Secondary alcohol - Amino acid - Amino acid or derivatives - Carboxylic acid derivative - Carboxylic acid - Organoheterocyclic compound - Acetal - Secondary amine - Oxacycle - Secondary aliphatic amine - Monocarboxylic acid or derivatives - Azacycle - Polyol - Organonitrogen compound - Alcohol - Carbonyl group - Hydrocarbon derivative - Primary aliphatic amine - Organic oxide - Organopnictogen compound - Organic nitrogen compound - Primary amine - Amine - Primary alcohol - Organohalogen compound - 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