Analyte Name

28-Ethylhydroxy Everolimus-d4 Impurity

Molecular Formula

C55 D4 H83 N O15

Molecular Weight

1006.302

Accurate Mass

1005.633

SMILES

[2H]C([2H])(O)C([2H])([2H])O[C@H]1[C@@H](OC)C(=O)[C@H](C)C[C@H](C)\C=C\C=C\C=C(/C)\[C@H](C[C@@H]2CC[C@@H](C)[C@@](O)(O2)C(=O)C(=O)N3CCCC[C@H]3C(=O)O[C@@H](CC(=O)[C@H](C)\C=C\1/C)[C@H](C)C[C@@H]4CC[C@@H](OCCO)[C@@H](C4)OC)OC

InChI

InChI=1S/C55H87NO15/c1-34-16-12-11-13-17-35(2)46(65-8)32-42-21-19-40(7)55(64,71-42)52(61)53(62)56-23-15-14-18-43(56)54(63)70-47(37(4)30-41-20-22-45(68-26-24-57)48(31-41)66-9)33-44(59)36(3)29-39(6)50(69-27-25-58)51(67-10)49(60)38(5)28-34/h11-13,16-17,29,34,36-38,40-43,45-48,50-51,57-58,64H,14-15,18-28,30-33H2,1-10H3/b13-11+,16-12+,35-17+,39-29+/t34-,36?,37-,38-,40-,41+,42+,43+,45-,46+,47+,48-,50-,51+,55-/m1/s1/i25D2,27D2

IUPAC

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

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat