Analytenname

24,32-Bis-O-(tert-butyldimethylsilyl)-FK-506-13C, D2

CAS-Nummer

1356352-20-9

Molekularformel

C5513CH95D2NO12Si2

Molekulargewicht

1035.54

Genaue Masse

1034.6708

SMILES

O=C([C@H](C/C=[13C]([2H])/[2H])/C=C(C)/C[C@H](C)C[C@H](OC)[C@](O1)([H])[C@@H](OC)C[C@@H](C)[C@]1(O)C2=O)C[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](C)C(OC([C@@H]3CCCCN3C2=O)=O)/C(C)=C/[C@@H]4C[C@@H](OC)[C@H](O[Si](C)(C)C(C)(C)C)CC4

InChI

InChI=1S/C56H97NO12Si2/c1-20-23-41-29-35(2)28-36(3)30-47(64-14)50-48(65-15)32-38(5)56(62,67-50)51(59)52(60)57-27-22-21-24-42(57)53(61)66-49(39(6)45(34-43(41)58)69-71(18,19)55(10,11)12)37(4)31-40-25-26-44(46(33-40)63-13)68-70(16,17)54(7,8)9/h20,29,31,36,38-42,44-50,62H,1,21-28,30,32-34H2,2-19H3/b35-29?,37-31+/t36-,38+,39+,40-,41+,42-,44+,45-,46+,47-,48-,49+,50+,56+/m0/s1/i1+1D2

IUPAC

(1R,9S,12S,13S,14S,17R,21S,23S,24R,25S,27R)-14-[tert-butyl(dimethyl)silyl]oxy-12-[(E)-1-[(1R,3R,4R)-4-[tert-butyl(dimethyl)silyl]oxy-3-methoxycyclohexyl]prop-1-en-2-yl]-17-(3,3-dideuterio(313C)prop-2-enyl)-1-hydroxy-23,25-dimethoxy-13,19,21,27-tetramethyl-11,28-dioxa-4-azatricyclo[22.3.1.04,9]octacos-18-ene-2,3,10,16-tetrone

Nicht gekennzeichnete CAS-Nummer

133941-75-0

SIL-Typ

Carbon, Deuterium

Lagertemperatur

-20°C

Versandtemperatur

Room Temperature

Herkunftsland

CANADA

Produkttyp

Impurity; Stable Isotope Labelled

Produktformat

Neat

Impurity Type

Intermediate

API-Familie

Tacrolimus