Cefepime-D8 Sulfate

Analyte Name

Cefepime sulfate pyrrolidinium-d8

CAS Number

131857-33-5

Molecular Formula

C19 2H8 H16 N6 O5 S2 . H2 O4 S

Molecular Weight

586.69

Accurate Mass

586.1426

SMILES

[2H]C1([2H])C([2H])([2H])C([2H])([2H])[N+](C)(CC2=C(N3[C@H](SC2)[C@H](NC(=O)\C(=N/OC)\c4csc(N)n4)C3=O)C(=O)[O-])C1([2H])[2H].OS(=O)(=O)O

InChI

InChI=1S/C19H24N6O5S2.H2O4S/c1-25(5-3-4-6-25)7-10-8-31-17-13(16(27)24(17)14(10)18(28)29)22-15(26)12(23-30-2)11-9-32-19(20)21-11;1-5(2,3)4/h9,13,17H,3-8H2,1-2H3,(H3-,20,21,22,26,28,29);(H2,1,2,3,4)/b23-12-;/t13-,17-;/m1./s1/i3D2,4D2,5D2,6D2;

IUPAC

(6R,7R)-7-[[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-methoxyiminoacetyl]amino]-3-[(2,2,3,3,4,4,5,5-octadeuterio-1-methylpyrrolidin-1-ium-1-yl)methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate;sulfuric acid

Alternate CAS Number

Free base: 88376-58-3

Unlabelled CAS Number

107648-78-2

SIL Type

Deuterium

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Stable Isotope Labelled

Product Format

Neat

API Family

Cefepime Hydrochloride; Cefepime

Purity

>95% (HPLC)