Analyte Name

Dimethyl-d-tubocurarine-d6 Iodide

Molecular Formula

C39 D6 H39 N2 O6 . I

Molecular Weight

770.726

Accurate Mass

770.27

SMILES

[I-].[2H]C([2H])([2H])Oc1ccc2C[C@@H]3c4c(CC[N+]3(C)C)cc(OC)c(OC([2H])([2H])[2H])c4Oc5ccc(C[C@@H]6N(C)CCc7cc(OC)c(Oc1c2)cc67)cc5

InChI

InChI=1S/C39H45N2O6.HI/c1-40-16-14-26-21-33(43-5)35-23-29(26)30(40)18-24-8-11-28(12-9-24)46-39-37-27(22-36(44-6)38(39)45-7)15-17-41(2,3)31(37)19-25-10-13-32(42-4)34(20-25)47-35;/h8-13,20-23,30-31H,14-19H2,1-7H3;1H/q+1;/p-1/t30-,31+;/m0./s1/i4D3,7D3;

IUPAC

(1S,16R)-10,25-dimethoxy-15,15,30-trimethyl-9,21-bis(trideuteriomethoxy)-7,23-dioxa-30-aza-15-azoniaheptacyclo[22.6.2.23,6.18,12.118,22.027,31.016,34]hexatriaconta-3,5,8(34),9,11,18,20,22(33),24,26,31,35-dodecaene;iodide

Unlabelled CAS Number

36653-49-3

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat