Nombre del analito

trans R-138727-d4, (Prasugrel-d4 Metabolite)(Mixture of Diastereomers)

Fórmula molecular

C18 D4 H16 F N O3 S

Peso molecular

353.444

Masa exacta

353.14

SMILES

[2H]C1([2H])C(C(=O)C(N2CCC(S)\C(=C\C(=O)O)\C2)c3ccccc3F)C1([2H])[2H]

InChI

InChI=1S/C18H20FNO3S/c19-14-4-2-1-3-13(14)17(18(23)11-5-6-11)20-8-7-15(24)12(10-20)9-16(21)22/h1-4,9,11,15,17,24H,5-8,10H2,(H,21,22)/b12-9+/i5D2,6D2

IUPAC

(2E)-2-[1-[1-(2-fluorophenyl)-2-oxo-2-(2,2,3,3-tetradeuteriocyclopropyl)ethyl]-4-sulfanylpiperidin-3-ylidene]acetic acid

Número CAS sin etiquetar

239466-74-1

Tipo SIL

Deuterium

Temperatura de envío

Room Temperature

País de origen

CANADA

Formato del producto

Neat