5-O-[(1,1-Dimethylethyl)dimethylsilyl] 3”-O-Demethyl Ivermectin-2,6-dideoxy-3,4-diacetato alpha-L-Glucopyranose

Analyte Name

5-O-[(1,1-Dimethylethyl)dimethylsilyl] 3''-O-Demethyl Ivermectin-2,6-dideoxy-3,4-diacetato alpha-L-Glucopyranose

Molecular Formula

C57H90O16Si

Molecular Weight

1059.4

Accurate Mass

1058.6

SMILES

O[C@]1([C@](C=C2C)([H])C(O[C@]3([H])C[C@](O[C@]4([H])[C@@H](C)CC)(CC[C@@H]4C)O[C@@](C/C=C5\C)([H])C3)=O)[C@]([C@@H]2O[Si](C)(C)C(C)(C)C)([H])OC/C1=C\C=C\[C@@H]([C@@H]5O[C@@](O[C@@H](C)[C@@H]6OC7C[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@H](C)O7)([H])C[C@@H]6OC)C

InChI

InChI=1S/C57H90O16Si/c1-17-31(2)49-34(5)23-24-56(72-49)29-42-26-41(71-56)22-21-33(4)48(69-46-27-44(62-14)51(36(7)64-46)70-47-28-45(66-38(9)58)52(37(8)65-47)67-39(10)59)32(3)19-18-20-40-30-63-53-50(73-74(15,16)55(11,12)13)35(6)25-43(54(60)68-42)57(40,53)61/h18-21,25,31-32,34,36-37,41-53,61H,17,22-24,26-30H2,1-16H3/b19-18+,33-21+,40-20+/t31-,32-,34-,36-,37-,41+,42-,43-,44-,45-,46-,47?,48-,49+,50+,51-,52-,53+,56+,57+/m0/s1

IUPAC

(2S,3S,4S)-6-(((2S,3S,4S,6R)-6-(((2R,2a'E,2a1'S,4'E,5S,6R,6'S,7'S,8'E,11'R,15'S,17a'R,20'R,20a'R)-6-((S)-sec-butyl)-20'-((tert-butyldimethylsilyl)oxy)-2a1'-hydroxy-5,6',8',19'-tetramethyl-17'-oxo-2a1',3,4,5,6,6',10',11',14',15',17',17a',20',20a'-tetradecahydro-2'H,7'H-spiro[pyran-2,13'-[11,15]methano[1,5]dioxacyclooctadecino[9,8,7-cd]benzofuran]-7'-yl)oxy)-4-methoxy-2-methyltetrahydro-2H-pyran-3-yl)oxy)-2-methyltetrahydro-2H-pyran-3,4-diyl diacetate

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat