O-Tri-t-Butyldimethylsilyl Tylosin Acetate-d3

Analyte Name

O-Tri-t-Butyldimethylsilyl Tylosin Acetate-d3

Molecular Formula

C66 D3 H118 N O18 Si3

Molecular Weight

1303.938

Accurate Mass

1302.808

SMILES

[2H]C([2H])([2H])N(C)[C@H]1[C@H](O[C@H]2C[C@@](C)(O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](C)O2)[C@@H](C)O[C@@H](O[C@H]3[C@H](C)[C@@H]4CC(=O)O[C@H](CC)[C@@H](CO[C@@H]5O[C@H](C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H](OC)[C@H]5OC)\C=C(/C)\C=C\C(=O)[C@H](C)CC3C[C@@H](O[Si](C)(C)C(C)(C)C)O4)[C@@H]1OC(=O)C

InChI

InChI=1S/C66H121NO18Si3/c1-29-48-46(37-74-61-59(73-22)58(72-21)56(42(6)76-61)84-87(25,26)64(12,13)14)32-38(2)30-31-47(69)39(3)33-45-34-51(83-86(23,24)63(9,10)11)80-49(35-50(70)79-48)40(4)54(45)82-62-57(78-44(8)68)53(67(19)20)55(41(5)77-62)81-52-36-66(18,71)60(43(7)75-52)85-88(27,28)65(15,16)17/h30-32,39-43,45-46,48-49,51-62,71H,29,33-37H2,1-28H3/b31-30+,38-32+/t39-,40-,41-,42-,43+,45?,46-,48-,49+,51-,52+,53+,54+,55-,56-,57-,58-,59-,60+,61-,62+,66-/m1/s1/i19D3

IUPAC

[(2R,3R,4S,5S,6R)-2-[[(1S,5R,6R,7E,9E,12R,16R,18R,19R)-16-[tert-butyl(dimethyl)silyl]oxy-6-[[(2R,3R,4S,5R,6R)-5-[tert-butyl(dimethyl)silyl]oxy-3,4-dimethoxy-6-methyloxan-2-yl]oxymethyl]-5-ethyl-8,12,18-trimethyl-3,11-dioxo-4,17-dioxabicyclo[12.3.2]nonadeca-7,9-dien-19-yl]oxy]-5-[(2S,4R,5S,6S)-5-[tert-butyl(dimethyl)silyl]oxy-4-hydroxy-4,6-dimethyloxan-2-yl]oxy-6-methyl-4-[methyl(trideuteriomethyl)amino]oxan-3-yl] acetate

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat