Nazwa analitu

alpha-Cyclodextrin Deuterated

Wzór cząsteczkowy

C36H42D18O30

Masa cząsteczkowa

990.96

Dokładna masa

990.43

SMILES

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

InChI

InChI=1S/C36H60O30/c37-1-7-25-13(43)19(49)31(55-7)62-26-8(2-38)57-33(21(51)15(26)45)64-28-10(4-40)59-35(23(53)17(28)47)66-30-12(6-42)60-36(24(54)18(30)48)65-29-11(5-41)58-34(22(52)16(29)46)63-27-9(3-39)56-32(61-25)20(50)14(27)44/h7-54H,1-6H2/t7-,8-,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-/m1/s1/i1D2,2D2,3D2,4D2,5D2,6D2,19D,20D,21D,22D,23D,24D

IUPAC

(1S,3R,5R,6S,8R,10R,11S,13R,15R,16S,18R,20R,21S,23R,25R,26S,28R,30R,32S,33R,34R,35S,36R,37S,38R,40S,42S)-32,34,36,38,40,42-hexadeuterio-5,10,15,20,25,30-hexakis[dideuterio(hydroxy)methyl]-2,4,7,9,12,14,17,19,22,24,27,29-dodecaoxaheptacyclo[26.2.2.23,6.28,11.213,16.218,21.223,26]dotetracontane-31,32,33,34,35,36,37,38,39,40,41,42-dodecol

Zastępczy numer CAS

10016-20-3

Nieoznakowany numer CAS

10016-20-3

Typ SIL

Deuterium

Temperatura podczas transportu

Room Temperature

Kraj pochodzenia

CANADA

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