Nombre del analito

Cemadotin-d7

Fórmula molecular

C35 D7 H49 N6 O5

Peso molecular

647.899

Masa exacta

647.475

SMILES

[2H]c1c([2H])c([2H])c(c([2H])c1[2H])C([2H])([2H])NC(=O)[C@@H]2CCCN2C(=O)[C@H]3CCCN3C(=O)C(C(C)C)N(C)C(=O)C(NC(=O)C(C(C)C)N(C)C)C(C)C

InChI

InChI=1S/C35H56N6O5/c1-22(2)28(37-32(43)29(23(3)4)38(7)8)34(45)39(9)30(24(5)6)35(46)41-20-14-18-27(41)33(44)40-19-13-17-26(40)31(42)36-21-25-15-11-10-12-16-25/h10-12,15-16,22-24,26-30H,13-14,17-21H2,1-9H3,(H,36,42)(H,37,43)/t26-,27+,28?,29?,30?/m0/s1/i10D,11D,12D,15D,16D,21D2

IUPAC

(2S)-N-[dideuterio-(2,3,4,5,6-pentadeuteriophenyl)methyl]-1-[(2R)-1-[2-[[2-[[2-(dimethylamino)-3-methylbutanoyl]amino]-3-methylbutanoyl]-methylamino]-3-methylbutanoyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carboxamide

Número CAS sin etiquetar

159776-69-9

Tipo SIL

Deuterium

Temperatura de envío

Room Temperature

País de origen

CANADA

Tipo de producto

Stable Isotope Labelled

Formato del producto

Neat