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Framycetin sulphate

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Name

Framycetin sulphate

EINECS 223-969-3
CAS No. 4146-30-9 Density N/A
PSA 436.09000 LogP -4.26550
Solubility N/A Melting Point N/A
Formula C23H46N6O13.H2SO4 Boiling Point 927.1 °C at 760 mmHg
Molecular Weight 908.889 Flash Point 514.5 °C
Transport Information N/A Appearance COA
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 4146-30-9 (Framycetin sulphate) Hazard Symbols N/A
Synonyms

(2R,3S,4S,5S,6S)-5-amino-2-(aminomethyl)-6-[(2R,3R,4R,5S)-5-[(1S,2R,3S,5R,6S)-3,5-diamino-2-[(2R,3R,4R,5R,6R)-3-amino-6-(aminomethyl)-4,5-dihydroxy-oxan-2-yl]oxy-6-hydroxy-cyclohexyl]oxy-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl]oxy-oxane-3,4-diol; sulfuric acid;Neomycin sulphate B(Framycetin sulphate);Neomycin sulphate B;

Article Data 3

Framycetin sulphate Specification

The IUPAC name of Framycetin sulphate is (2R,3S,4R,5R,6R)-5-amino-2-(aminomethyl)-6-[(1R,2R,3S,4R,6S)-4,6-diamino-2-[(2S,3R,4S,5R)-4-[(2S,3S,4S,5R,6R)-3-amino-6-(aminomethyl)-4,5-dihydroxyoxan-2-yl]oxy-3-hydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-3-hydroxycyclohexyl]oxyoxane-3,4-diol; sulfuric acid. With the CAS registry number 4146-30-9, it is also named as Neomycin sulphate B. Besides, it is white to yellowish powder. In addition, its molecular formula is C23H48N6O17S and its molecular weight is 712.72.

The other characteristics of Framycetin sulphate can be summarized as: (1)EINECS: 223-969-3; (2)H-Bond Donor: 15; (3)H-Bond Acceptor: 23; (4)Rotatable Bond Count: 9; (5)Exact Mass: 712.279665; (6)MonoIsotopic Mass: 712.279665; (7)Topological Polar Surface Area: 436; (8)Heavy Atom Count: 47; (9)Complexity: 953; (10)Isotope Atom Count: 0; (11)Defined Atom StereoCenter Count: 19; (12)Flash Point: 514.5 °C; (13)Enthalpy of Vaporization: 153.02 kJ/mol; (14)Boiling Point: 927.1 °C at 760 mmHg; (15)Vapour Pressure: 0 mmHg at 25 °C.

People can use the following data to convert to the molecule structure.
(1)SMILES: O=S(=O)(O)O.O([C@H]3[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@H]1O[C@@H](CN)[C@@H](O)[C@H](O)[C@H]1N)[C@H]2O)[C@@H](O)[C@H](N)C[C@@H]3N)[C@H]4O[C@@H]([C@@H](O)[C@H](O)[C@H]4N)CN
(2)InChI: InChI=1/C23H46N6O13.H2O4S/c24-2-7-13(32)15(34)10(28)21(37-7)40-18-6(27)1-5(26)12(31)20(18)42-23-17(36)19(9(4-30)39-23)41-22-11(29)16(35)14(33)8(3-25)38-22;1-5(2,3)4/h5-23,30-36H,1-4,24-29H2;(H2,1,2,3,4)/t5-,6+,7-,8+,9-,10-,11-,12+,13-,14-,15-,16-,17-,18-,19-,20-,21-,22-,23+;/m1./s1
(3)InChIKey: OIXVKQDWLFHVGR-WQDIDPJDBL

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