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Product Overview

Product Code

TRC-D289907

Product Format

Neat

Molecular Formula

C17H17D3N6O7S4

Molecular Weight

551.66

Product Categories

TRC, Antibiotics, Antibiotics, Antibiotics, Stable isotopes, Stable Isotope Labelled Analytical Standards, Pharmaceutical Toxicology Reference Materials

Product Type

Stable Isotope Labelled

Unlabelled CAS Number

158039-15-7

Documentation

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Product Information

Chemical Data

Analyte Name

Desfuroyl Ceftiofur Cysteine Disulfide-d3

Molecular Formula

C17H17D3N6O7S4

Molecular Weight

551.66

Accurate Mass

551.05

SMILES

[H][C@]12N(C(C(O)=O)=C(CSSC[C@H](N)C(O)=O)CS2)C([C@H]1NC(/C(C3=CSC(N)=N3)=N\OC([2H])([2H])[2H])=O)=O

InChI

InChI=1S/C17H20N6O7S4/c1-30-22-9(8-5-32-17(19)20-8)12(24)21-10-13(25)23-11(16(28)29)6(2-31-14(10)23)3-33-34-4-7(18)15(26)27/h5,7,10,14H,2-4,18H2,1H3,(H2,19,20)(H,21,24)(H,26,27)(H,28,29)/b22-9-/t7-,10+,14+/m0/s1/i1D3

IUPAC

(6R,7R)-3-((((R)-2-amino-2-carboxyethyl)disulfaneyl)methyl)-7-((Z)-2-(2-aminothiazol-4-yl)-2-((methoxy-d3)imino)acetamido)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Unlabelled CAS Number

158039-15-7

SIL Type

Deuterium

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Stable Isotope Labelled

Product Format

Neat

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Product Overview

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Chemical Data

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Desfuroyl Ceftiofur Cysteine Disulfide-d3 (~90%)

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