Analyte Name

31-Oxo-13-tert-Butyldimethylsilyloxyethyl Everolimus

Molecular Formula

C60 H95 N O14

Molecular Weight

1054.395

Accurate Mass

1053.675

SMILES

CO[C@@H]1C[C@H](C[C@@H](C)[C@@H]2CC(=O)[C@H](C)\C=C(/C)\C(=O)[C@@H](OC)C(=O)[C@H](C)C[C@H](C)\C=C\C=C\C=C(/C)\[C@H](C[C@@H]3CC[C@@H](C)[C@@](O)(O3)C(=O)C(=O)N4CCCC[C@H]4C(=O)O2)OC)CC[C@H]1OCCOC(C)(C)C(C)(C)C

InChI

InChI=1S/C60H95NO14/c1-37-21-17-16-18-22-38(2)49(69-13)35-45-26-24-43(7)60(68,75-45)55(65)56(66)61-28-20-19-23-46(61)57(67)74-50(36-47(62)39(3)32-42(6)53(64)54(71-15)52(63)41(5)31-37)40(4)33-44-25-27-48(51(34-44)70-14)72-29-30-73-59(11,12)58(8,9)10/h16-18,21-22,32,37,39-41,43-46,48-51,54,68H,19-20,23-31,33-36H2,1-15H3/b18-16+,21-17+,38-22+,42-32+/t37-,39?,40-,41-,43-,44+,45+,46+,48-,49+,50+,51-,54+,60-/m1/s1

IUPAC

(1R,9S,12S,15R,16E,19S,21R,23S,24E,26E,28E,30S,32S,35R)-1-hydroxy-19,30-dimethoxy-12-[(2R)-1-[(1S,3R,4R)-3-methoxy-4-[2-(2,3,3-trimethylbutan-2-yloxy)ethoxy]cyclohexyl]propan-2-yl]-15,17,21,23,29,35-hexamethyl-11,36-dioxa-4-azatricyclo[30.3.1.04,9]hexatriaconta-16,24,26,28-tetraene-2,3,10,14,18,20-hexone

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat