Analyte Name

(2S)-2-(((3R,4R)-4-(3-hydroxyphenyl)-3,4-dimethylpiperidin-1-yl)methyl)-3-(2,3,4,5,6-pentadeuteriophenyl)propanoic acid

Molecular Formula

C23 D5 H24 N O3

Molecular Weight

372.512

Accurate Mass

372.246

SMILES

[2H]c1c([2H])c([2H])c(C[C@@H](CN2CC[C@](C)([C@@H](C)C2)c3cccc(O)c3)C(=O)O)c([2H])c1[2H]

InChI

InChI=1S/C23H29NO3/c1-17-15-24(12-11-23(17,2)20-9-6-10-21(25)14-20)16-19(22(26)27)13-18-7-4-3-5-8-18/h3-10,14,17,19,25H,11-13,15-16H2,1-2H3,(H,26,27)/t17-,19-,23+/m0/s1/i3D,4D,5D,7D,8D

IUPAC

(2S)-2-[[(3R,4R)-4-(3-hydroxyphenyl)-3,4-dimethylpiperidin-1-yl]methyl]-3-(2,3,4,5,6-pentadeuteriophenyl)propanoic acid

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat