Pentadecasodium [2,3-Disulfonatooxy-5-[(2S,3R,4S,5R,6R)-2,3,5-Tris[(3,4,5-Trisulfonatooxybenzoyl)Oxy]-6-[(3,4,5-Trisulfonatooxybenzoyl)Oxymethyl]Oxan-4-Yl]Oxycarbonylphenyl] Sulfate
[CAS# 179465-88-4]

Identification

• Name: Pentadecasodium [2,3-Disulfonatooxy-5-[(2S,3R,4S,5R,6R)-2,3,5-Tris[(3,4,5-Trisulfonatooxybenzoyl)Oxy]-6-[(3,4,5-Trisulfonatooxybenzoyl)Oxymethyl]Oxan-4-Yl]Oxycarbonylphenyl] Sulfate
• Synonyms: Pentadecasodium [2,3-Disulfonatooxy-5-[(2S,3R,4S,5R,6R)-2,3,5-Tris[(3,4,5-Trisulfonatooxybenzoyl)Oxy]-6-[(3,4,5-Trisulfonatooxybenzoyl)Oxymethyl]Tetrahydropyran-4-Yl]Oxycarbonyl-Phenyl] Sulfate; Pentadecasodium [5-[Oxo-[[(2S,3R,4S,5R,6R)-2,3,5-Tris[Oxo-(3,4,5-Trisulfonatooxyphenyl)Methoxy]-6-[[Oxo-(3,4,5-Trisulfonatooxyphenyl)Methoxy]Methyl]-4-Tetrahydropyranyl]Oxy]Methyl]-2,3-Disulfonatooxyphenyl] Sulfate; Pentadecasodium [2,3-Disulfato-5-[(2S,3R,4S,5R,6R)-2,3,5-Tris[(3,4,5-Trisulfatobenzoyl)Oxy]-6-[(3,4,5-Trisulfatobenzoyl)Oxymethyl]Tetrahydropyran-4-Yl]Oxycarbonyl-Phenyl] Sulfate
• Molecular Formula: C₄₁H₁₇Na₁₅O₇₁S₁₅
• Molecular Weight: 2471.29
• CAS Registry Number: 179465-88-4
• SMILES: [Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[C@@H]3(OC(=O)C1=CC(=C(O[S]([O-])(=O)=O)C(=C1)O[S]([O-])(=O)=O)O[S]([O-])(=O)=O)[C@@H](OC(=O)C2=CC(=C(O[S]([O-])(=O)=O)C(=C2)O[S]([O-])(=O)=O)O[S]([O-])(=O)=O)[C@@H](O[C@@H]([C@H]3OC(=O)C4=CC(=C(O[S]([O-])(=O)=O)C(=C4)O[S]([O-])(=O)=O)O[S]([O-])(=O)=O)COC(=O)C5=CC(=C(O[S]([O-])(=O)=O)C(=C5)O[S]([O-])(=O)=O)O[S]([O-])(=O)=O)OC(=O)C6=CC(=C(O[S]([O-])(=O)=O)C(=C6)O[S]([O-])(=O)=O)O[S]([O-])(=O)=O.[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]
• InChI: 1S/C41H32O71S15.15Na/c42-36(12-1-17(98-113(47,48)49)28(108-123(77,78)79)18(2-12)99-114(50,51)52)92-11-27-33(94-37(43)13-3-19(100-115(53,54)55)29(109-124(80,81)82)20(4-13)101-116(56,57)58)34(95-38(44)14-5-21(102-117(59,60)61)30(110-125(83,84)85)22(6-14)103-118(62,63)64)35(96-39(45)15-7-23(104-119(65,66)67)31(111-126(86,87)88)24(8-15)105-120(68,69)70)41(93-27)97-40(46)16-9-25(106-121(71,72)73)32(112-127(89,90)91)26(10-16)107-122(74,75)76;;;;;;;;;;;;;;;/h1-10,27,33-35,41H,11H2,(H,47,48,49)(H,50,51,52)(H,53,54,55)(H,56,57,58)(H,59,60,61)(H,62,63,64)(H,65,66,67)(H,68,69,70)(H,71,72,73)(H,74,75,76)(H,77,78,79)(H,80,81,82)(H,83,84,85)(H,86,87,88)(H,89,90,91);;;;;;;;;;;;;;;/q;15*+1/p-15/t27-,33-,34+,35-,41+;;;;;;;;;;;;;;;/m1.............../s1
• InChIKey: LBWYLPIZCCOUQX-MWKYKVQMSA-A