Levomefolic Acid-13C,d3

Analyte Name

Levomefolic acid N-methyl-13C,d3

CAS Number

1356019-94-7

Molecular Formula

13C C19 2H3 H22 N7 O6

Molecular Weight

463.47

Accurate Mass

463.2088

SMILES

[2H][13C]([2H])([2H])N1[C@@H](CNc2ccc(cc2)C(=O)N[C@@H](CCC(=O)O)C(=O)O)CNC3=C1C(=O)N=C(N)N3

InChI

InChI=1S/C20H25N7O6/c1-27-12(9-23-16-15(27)18(31)26-20(21)25-16)8-22-11-4-2-10(3-5-11)17(30)24-13(19(32)33)6-7-14(28)29/h2-5,12-13,22H,6-9H2,1H3,(H,24,30)(H,28,29)(H,32,33)(H4,21,23,25,26,31)/t12-,13-/m0/s1/i1+1D3

IUPAC

(2S)-2-[[4-[[(6S)-2-amino-4-oxo-5-(trideuterio(1^{13}C)methyl)-1,6,7,8-tetrahydropteridin-6-yl]methylamino]benzoyl]amino]pentanedioic acid

Unlabelled CAS Number

31690-09-2

SIL Type

Deuterium, Carbon

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Impurity; Stable Isotope Labelled

Product Format

Neat

API Family

Levomefolic Acid

Purity

>95% (HPLC)