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Substance Name: gamma-Cyclodextrin, 6A,6B,6C,6D,6E,6F,6G,6H-octakis(2-hydroxypropyl)-
RN: 116502-52-4
InChIKey: JVFGXECLSQXABC-UHFFFAOYSA-N

Molecular Formula

  • C72-H128-O48

Molecular Weight

  • 1761.76
 
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Names and Synonyms

Synonym

  • 6A,6B,6C,6D,6E,6F,6G,6H-Octakis(2-hydroxypropyl)-gamma-cyclodextrin

Systematic Name

  • gamma-Cyclodextrin, 6A,6B,6C,6D,6E,6F,6G,6H-octakis(2-hydroxypropyl)-

Registry Numbers

CAS Registry Number

  • 116502-52-4

System Generated Number

  • 0116502524

Structure Descriptors

InChI

1S/C72H128O48/c1-25(73)9-97-17-33-57-41(81)49(89)65(105-33)114-58-34(18-98-10-26(2)74)107-67(51(91)43(58)83)116-60-36(20-100-12-28(4)76)109-69(53(93)45(60)85)118-62-38(22-102-14-30(6)78)111-71(55(95)47(62)87)120-64-40(24-104-16-32(8)80)112-72(56(96)48(64)88)119-63-39(23-103-15-31(7)79)110-70(54(94)46(63)86)117-61-37(21-101-13-29(5)77)108-68(52(92)44(61)84)115-59-35(19-99-11-27(3)75)106-66(113-57)50(90)42(59)82/h25-96H,9-24H2,1-8H3

InChIKey

JVFGXECLSQXABC-UHFFFAOYSA-N

Smiles

O1[C@@H]2[C@@H](O)[C@@H](O)[C@@H](O[C@@H]3[C@@H]([C@@H]([C@@H]([C@@H](COC[C@@H](C)O)O3)O[C@@H]3O[C@@H](COC[C@@H](C)O)[C@@H](O[C@@H]4[C@@H]([C@@H]([C@@H]([C@@H](O4)COC[C@@H](C)O)O[C@@H]4O[C@@H]([C@@H](O[C@@H]5[C@@H](O)[C@@H](O)[C@@H](O[C@@H]6O[C@@H]([C@@H](O[C@@H]7O[C@@H]([C@@H]([C@@H](O)[C@@H]7O)O2)COC[C@@H](O)C)[C@@H]([C@@H]6O)O)COC[C@@H](C)O)[C@@H](COC[C@@H](C)O)O5)[C@@H]([C@@H]4O)O)COC[C@@H](C)O)O)O)[C@@H](O)[C@@H]3O)O)O)[C@@H]1COC[C@@H](C)O