Cas no 197587-31-8 (Heptakis(6-O-sulfo)-b-cyclodextrin Heptasodium Salt (>90%))

Heptakis(6-O-sulfo)-β-cyclodextrin Heptasodium Salt (>90%) is a highly sulfated derivative of β-cyclodextrin, characterized by seven sulfate groups per molecule, each positioned at the 6-O site of the glucose units. This modification enhances its water solubility and anionic character, making it particularly useful in applications requiring strong host-guest interactions, such as chiral separations, drug delivery, and molecular encapsulation. The heptasodium salt form ensures improved stability and handling. With a purity exceeding 90%, this compound is suitable for analytical and preparative purposes in pharmaceutical and biochemical research, where precise molecular recognition and solubility enhancement are critical. Its consistent performance and high degree of sulfation make it a reliable choice for specialized applications.
Heptakis(6-O-sulfo)-b-cyclodextrin Heptasodium Salt (>90%) structure
197587-31-8 structure
Product Name:Heptakis(6-O-sulfo)-b-cyclodextrin Heptasodium Salt (>90%)
CAS No:197587-31-8
MF:C42H63O56S7Na7
MW:1849.29962
CID:136857
PubChem ID:102601748
Update Time:2025-10-19

Heptakis(6-O-sulfo)-b-cyclodextrin Heptasodium Salt (>90%) Chemical and Physical Properties

Names and Identifiers

    • b-Cyclodextrin,6A,6B,6C,6D,6E,6F,6G-heptakis(hydrogen sulfate), sodium salt (1:7)
    • HEPTAKIS(6-O-SULFO)-(BETA)-CYCLODEXTRIN
    • Heptakis(6-O-sulfo)-β-cyclodextrin Heptasodium Salt
    • Hs--CD
    • 6-o-sulfo-β-cyclodextrin sodium salt
    • 6-O-Sulfo-β-cyclodextrin sodium salt, Hs-β-CD
    • b-Cyclodextrin,6a,6b,6c,6d,6e,6f,6g-heptakis(hydrogen sulfate),sodium salt(1:7)
    • 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
    • 197587-31-8
    • Heptasodium;[(1S,3R,6S,8R,11S,13R,16S,18R,21S,23S,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
    • Heptakis(6-O-sulfo)-?-cyclodextrin Heptasodium Salt (>90%)
    • Heptakis(6-O-sulfo)-beta-cyclodextrin heptasodium salt
    • 6-O-Sulfo-b-cyclodextrin sodium salt
    • HEPTAKIS(6-O-SULFO)-(BETA)-CYCLODEXTRIN HEPTASODIUM SALT 98%
    • Heptakis(6-O-sulfo)-b-cyclodextrin Heptasodium Salt (>90%)
    • 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-VJYQDBNESA-G
    • SMILES: O[C@@H]1[C@H]2OC(COS(O[Na])(=O)=O)[C@@H](O[C@@H]3[C@@H](O)[C@@H](O)[C@H](O[C@@H]4[C@@H](O)[C@@H](O)[C@H](O[C@@H]5[C@@H](O)[C@@H](O)[C@H](O[C@@H]6[C@@H](O)[C@@H](O)[C@H](O[C@@H]7[C@@H](O)[C@@H](O)[C@H](O[C@@H]8[C@@H](O)[C@@H](O)[C@H](O2)C(COS(O[Na])(=O)=O)O8)C(COS(O[Na])(=O)=O)O7)C(COS(O[Na])(=O)=O)O6)C(COS(O[Na])(=O)=O)O5)C(COS(O[Na])(=O)=O)O4)C(COS(O[Na])(=O)=O)O3)[C@@H]1O

Computed Properties

  • Exact Mass: 1847.9410789g/mol
  • Monoisotopic Mass: 1847.9410789g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 14
  • Hydrogen Bond Acceptor Count: 56
  • Heavy Atom Count: 112
  • Rotatable Bond Count: 14
  • Complexity: 2910
  • Covalently-Bonded Unit Count: 8
  • Defined Atom Stereocenter Count: 14
  • Undefined Atom Stereocenter Count : 21
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 936?2

Experimental Properties

  • Melting Point: >250°C (dec)

Heptakis(6-O-sulfo)-b-cyclodextrin Heptasodium Salt (>90%) Security Information

  • WGK Germany:3
  • FLUKA BRAND F CODES:10-21

Heptakis(6-O-sulfo)-b-cyclodextrin Heptasodium Salt (>90%) Pricemore >>

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