AG00ICHB

74135-10-7 | a-D-Glucopyranoside, 1,3,4,6-tetra-O-sulfo-b-D-fructofuranosyl,tetrakis(hydrogen sulfate), octasodium salt

AG00ICHB

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CAS Number	74135-10-7
Catalog Number	AG00ICHB(AGN-PC-0U4JFN)
Chemical Name	a-D-Glucopyranoside, 1,3,4,6-tetra-O-sulfo-b-D-fructofuranosyl,tetrakis(hydrogen sulfate), octasodium salt
EC Number	420-660-7
IUPAC Name	octasodium;[(2R,3R,4S,5R,6R)-2-[(2S,3S,4R,5R)-3,4-disulfonatooxy-2,5-bis(sulfonatooxymethyl)oxolan-2-yl]oxy-3,5-disulfonatooxy-6-(sulfonatooxymethyl)oxan-4-yl] sulfate
InChI	InChI=1S/C12H22O35S8.8Na/c13-48(14,15)37-1-4-6(43-51(22,23)24)8(45-53(28,29)30)9(46-54(31,32)33)11(40-4)42-12(3-39-50(19,20)21)10(47-55(34,35)36)7(44-52(25,26)27)5(41-12)2-38-49(16,17)18;;;;;;;;/h4-11H,1-3H2,(H,13,14,15)(H,16,17,18)(H,19,20,21)(H,22,23,24)(H,25,26,27)(H,28,29,30)(H,31,32,33)(H,34,35,36);;;;;;;;/q;8*+1/p-8/t4-,5-,6-,7-,8+,9-,10+,11-,12+;;;;;;;;/m1......../s1
InChI Key	CPRSOZZDECJZKH-QRDGSJRXSA-F
MDL Number	MFCD00933758
Molecular Formula	C12H14Na8O35S8
Molecular Weight	1158.6567
SMILES	[O-]S(O[C@@H]1[C@H](OS(=O)([O-])=O)[C@@H](OS(=O)([O-])=O)[C@@H](O[C@]2(COS([O-])(=O)=O)O[C@@H](COS([O-])(=O)=O)[C@@H](OS([O-])(=O)=O)[C@@H]2OS([O-])(=O)=O)O[C@@H]1COS([O-])(=O)=O)(=O)=O.[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]
UNII	S391KJ684Q
Synonyms	Sucrose octasulfate sodium salt, 74135-10-7, UNII-S391KJ684Q, S391KJ684Q, Sucrosofate sodium, Sodium sucrose octasulfate [INCI], C12H14Na8O35S8, Jsp001750, MFCD00933758, AKOS032947940, RL04803, alpha-D-Glucopyranoside, 1,3,4,6-tetra-O-sulfo-beta-D-fructofuranosyl, 2,3,4,6-tetrakis(hydrogen sulfate), sodium salt (1:8), FT-0641504, Y3336, C-35634, 1,3,4,6-Tetra-O-sulfo-b-D-fructofuranosyl-2,3,4,6-tetrakis(hydrogen sulfate)-a-D-glucopyranoside sodium salt, 1-O,3-O,4-O,6-O-Tetrakis(sodiosulfo)-beta-D-fructofuranosyl 2-O,3-O,4-O,6-O-tetrakis(sodiosulfo)-alpha-D-glucopyranoside, a-D-Glucopyranoside,1,3,4,6-tetra-O-sulfo-b-D-fructofuranosyl,tetrakis(hydrogen sulfate),sodium salt(9ci), Octasodium 1,3,4,6-tetra-O-sulfonato-beta-D-fructofuranosyl 2,3,4,6-tetra-O-sulfonato-alpha-D-glucopyranoside, Sodium Sucrose Octasulfate, Sucroseoctasulfatesodiumsalt, CID9833472, CID 9833472, Sucrose octasulfate sodium salt, 96% - 1G 1g, Sucrose octasulfate sodium salt, 98% - 500MG 500mg, 127930-09-0,

Complexity	2130
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	9
Defined Atom Stereocenter Count	9
Defined Bond Stereocenter Count	0
Exact Mass	1157.626g/mol
Formal Charge	0
Heavy Atom Count	63
Hydrogen Bond Acceptor Count	35
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	1158.607g/mol
Monoisotopic Mass	1157.626g/mol
Rotatable Bond Count	13
Topological Polar Surface Area	626A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P280-P301+P312-P302+P352-P305+P351+P338
UN Code

Certificate of Analysis

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