Analyte Name

7-O-(Triethylsilyl)-2'-O-tert-butyl(dimethyl)silyl-isocephalomannine

Molecular Formula

C57 H81 N O14 Si2

Molecular Weight

1060.422

Accurate Mass

1059.52

SMILES

CC[Si](CC)(CC)O[C@H]1C[C@H]2OC[C@@]2(OC(=O)C)[C@H]3[C@H](OC(=O)\C(=C\C)\C)[C@]4(O)C[C@H](OC(=O)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](NC(=O)c5ccccc5)c6ccccc6)C(=C([C@@H](OC(=O)C)C(=O)[C@]13C)C4(C)C)C

InChI

InChI=1S/C57H81NO14Si2/c1-17-34(5)51(63)69-49-47-55(14,41(71-74(18-2,19-3)20-4)31-42-56(47,33-66-42)70-37(8)60)48(61)45(67-36(7)59)43-35(6)40(32-57(49,65)54(43,12)13)68-52(64)46(72-73(15,16)53(9,10)11)44(38-27-23-21-24-28-38)58-50(62)39-29-25-22-26-30-39/h17,21-30,40-42,44-47,49,65H,18-20,31-33H2,1-16H3,(H,58,62)/b34-17+/t40-,41-,42+,44-,45+,46+,47-,49-,55+,56-,57+/m0/s1

IUPAC

[(1S,2S,3R,4S,7R,9S,10S,12R,15S)-4,12-diacetyloxy-15-[(2R,3S)-3-benzamido-2-[tert-butyl(dimethyl)silyl]oxy-3-phenylpropanoyl]oxy-1-hydroxy-10,14,17,17-tetramethyl-11-oxo-9-triethylsilyloxy-6-oxatetracyclo[11.3.1.03,10.04,7]heptadec-13-en-2-yl] (E)-2-methylbut-2-enoate

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat