| CAS Number | 197587-31-8 |
| Catalog Number | AG00ADIO(AGN-PC-0QP6E9) |
| Chemical Name | HEPTAKIS(6-O-SULFO)-(BETA)-CYCLODEXTRIN |
| IUPAC Name | heptasodium;[(1S,3R,6S,8R,11S,13R,16S,18S,21S,23R,26S,28R,31S,33R)-36,37,38,39,40,41,42,43,44,45,46,47,48,49-tetradecahydroxy-5,10,15,25,30,35-hexakis(sulfonatooxymethyl)-2,4,7,9,12,14,17,19,22,24,27,29,32,34-tetradecaoxaoctacyclo[31.2.2.23,6.28,11.213,16.218,21.223,26.228,31]nonatetracontan-20-yl]methyl sulfate |
| InChI | InChI=1S/C42H70O56S7.7Na/c43-15-22(50)36-85-8(1-78-99(57,58)59)29(15)92-37-23(51)16(44)31(10(86-37)3-80-101(63,64)65)94-39-25(53)18(46)33(12(88-39)5-82-103(69,70)71)96-41-27(55)20(48)35(14(90-41)7-84-105(75,76)77)98-42-28(56)21(49)34(13(91-42)6-83-104(72,73)74)97-40-26(54)19(47)32(11(89-40)4-81-102(66,67)68)95-38-24(52)17(45)30(93-36)9(87-38)2-79-100(60,61)62;;;;;;;/h8-56H,1-7H2,(H,57,58,59)(H,60,61,62)(H,63,64,65)(H,66,67,68)(H,69,70,71)(H,72,73,74)(H,75,76,77);;;;;;;/q;7*+1/p-7/t8?,9?,10?,11?,12?,13?,14?,15?,16?,17?,18?,19?,20?,21?,22?,23?,24?,25?,26?,27?,28?,29-,30-,31-,32-,33-,34-,35-,36-,37-,38-,39-,40-,41-,42+;;;;;;;/m1......./s1 |
| InChI Key | TZBDYIAUDQVKGF-ARCFIYGDSA-G |
| MDL Number | MFCD03095521 |
| Molecular Formula | C42H63Na7O56S7 |
| Molecular Weight | 1849.2994 |
| SMILES | O[C@H]1[C@@](O[C@](O[C@H](COS(=O)([O-])=O)[C@](O[C@](O[C@H](COS(=O)([O-])=O)[C@](O[C@](O[C@H](COS(=O)([O-])=O)[C@](O2)([H])[C@@H]3O)([H])[C@@H]3O)([H])[C@@H]4O)([H])[C@@H]4O)([H])[C@@H]5O)([H])[C@@H]5O)([H])[C@H](O[C@@](O[C@]([C@@H]6O)([H])[C@H](O[C@@](O[C@]([C@@H]7O)([H])[C@H](O[C@@](O[C@]([C@@H]8O)([H])[C@H](O[C@@]2([H])[C@@H]8O)COS(=O)([O-])=O)([H])[C@@H]7O)COS(=O)([O-])=O)([H])[C@@H]6O)COS(=O)([O-])=O)([H])[C@@H]1O)COS(=O)([O-])=O.[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+] |
| Synonyms | 197587-31-8,
Heptakis(6-O-sulfo)-|A-cyclodextrin heptasodium salt,
6-O-Sulfo-b-cyclodextrin sodium salt,
b-Cyclodextrin,6a,6b,6c,6d,6e,6f,6g-heptakis(hydrogen sulfate),sodium salt(1:7),
TZBDYIAUDQVKGF-ARCFIYGDSA-G,
|