Analyte Name

rac 4-Hydroxymethyl Ambrisentan-d3

CAS Number

1287096-42-7

Molecular Formula

C22H19D3N2O5

Molecular Weight

397.44

Accurate Mass

397.17

SMILES

OCC1=NC(OC(C(O)=O)C(C2=CC=CC=C2)(OC)C3=CC=CC=C3)=NC(C([2H])([2H])[2H])=C1

InChI

InChI=1S/C22H22N2O5/c1-15-13-18(14-25)24-21(23-15)29-19(20(26)27)22(28-2,16-9-5-3-6-10-16)17-11-7-4-8-12-17/h3-13,19,25H,14H2,1-2H3,(H,26,27)/i1D3

IUPAC

2-((4-(hydroxymethyl)-6-(methyl-d3)pyrimidin-2-yl)oxy)-3-methoxy-3,3-diphenylpropanoic acid

Unlabelled CAS Number

1106685-84-0

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Bioactive small molecule; Stable Isotope Labelled; API

Product Format

Neat