Analyte Name

N-Boc-Trimetazidine-d8

Molecular Formula

C26 H27 N O9

Molecular Weight

497.494

Accurate Mass

497.169

SMILES

COc1ccc(cc1)C2OCC3O[C@@H](Oc4ccc5C(=CC(=O)Oc5c4)C)C(NC(=O)C)C(O)[C@H]3O2

InChI

InChI=1S/C26H27NO9/c1-13-10-21(29)34-19-11-17(8-9-18(13)19)33-26-22(27-14(2)28)23(30)24-20(35-26)12-32-25(36-24)15-4-6-16(31-3)7-5-15/h4-11,20,22-26,30H,12H2,1-3H3,(H,27,28)/t20?,22?,23?,24-,25?,26+/m0/s1

IUPAC

N-[(6S,8aR)-8-hydroxy-2-(4-methoxyphenyl)-6-(4-methyl-2-oxochromen-7-yl)oxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl]acetamide

Unlabelled CAS Number

1428670-15-8

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Stable Isotope Labelled

Product Format

Neat