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Product Overview

Product Code

TRC-C244745

CAS Number

120962-17-6

Product Format

Neat

Molecular Formula

C19 H17 N5 O7 S3

Molecular Weight

523.563

Product Categories

TRC, Pharmaceutical and Veterinary Residue Reference Materials , Pharmaceutical Toxicology Reference Materials , Pharmaceutical Toxicology Reference Materials , Pharmaceutical and veterinary compounds and metabolites Reference Materials , Pharmaceutical, Veterinary Compound & Metabolite Reference Materials

Product Type

Impurity

Documentation

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Product Information

Chemical Data

Analyte Name

Delta3-Ceftiofur

CAS Number

120962-17-6

Molecular Formula

C19 H17 N5 O7 S3

Molecular Weight

523.563

Accurate Mass

523.029

SMILES

CO\N=C(/C(=O)N[C@H]1[C@H]2SC=C(CSC(=O)c3occc3)C(N2C1=O)C(=O)O)\c4csc(N)n4

InChI

InChI=1S/C19H17N5O7S3/c1-30-23-11(9-7-34-19(20)21-9)14(25)22-12-15(26)24-13(17(27)28)8(5-32-16(12)24)6-33-18(29)10-3-2-4-31-10/h2-5,7,12-13,16H,6H2,1H3,(H2,20,21)(H,22,25)(H,27,28)/b23-11-/t12-,13?,16-/m1/s1

IUPAC

(6R,7R)-7-[[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-methoxyiminoacetyl]amino]-3-(furan-2-carbonylsulfanylmethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-3-ene-2-carboxylic acid

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

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∆2-Ceftiofur

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