FV 100-d7 (Major)

Analyte Name

FV 100-d7 (Major)

Molecular Formula

C27 D7 H28 N3 O6

Molecular Weight

504.626

Accurate Mass

504.297

SMILES

[2H]C([2H])([2H])C([2H])([2H])C([2H])([2H])CCc1ccc(cc1)C2=CC3=CN([C@H]4CC(O)[C@H](COC(=O)[C@@H](N)C(C)C)O4)C(=O)N=C3O2

InChI

InChI=1S/C27H35N3O6/c1-4-5-6-7-17-8-10-18(11-9-17)21-12-19-14-30(27(33)29-25(19)36-21)23-13-20(31)22(35-23)15-34-26(32)24(28)16(2)3/h8-12,14,16,20,22-24,31H,4-7,13,15,28H2,1-3H3/t20?,22-,23+,24-/m0/s1/i1D3,4D2,5D2

IUPAC

[(2S,5R)-5-[6-[4-(3,3,4,4,5,5,5-heptadeuteriopentyl)phenyl]-2-oxofuro[2,3-d]pyrimidin-3-yl]-3-hydroxyoxolan-2-yl]methyl (2S)-2-amino-3-methylbutanoate

Unlabelled CAS Number

956483-02-6; 956483-03-7 HCl salt

SIL Type

Deuterium

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat