Cefoxitin-d3 Sodium Salt
Product Code
TRC-C243202-25MG
CAS Number
Product Format
Neat
Molecular Formula
C16 D3 H13 N3 O7 S2 . Na
Molecular Weight
452.452
Product Categories
TRC, Stable isotopes, Pharmaceutical Toxicology Reference Materials
Product Type
Stable Isotope LabelledDocumentation
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Product Information
Chemical Data
Analyte Name
Cefoxitin-d3 Sodium Salt
CAS Number
1316289-46-9
Molecular Formula
C16 D3 H13 N3 O7 S2 . Na
Molecular Weight
452.452
Accurate Mass
452.052
SMILES
[Na+].[2H]C([2H])([2H])O[C@]1(N=C([O-])Cc2cccs2)[C@H]3SCC(=C(N3C1=O)C(=O)O)COC(=O)N
InChI
InChI=1S/C16H17N3O7S2.Na/c1-25-16(18-10(20)5-9-3-2-4-27-9)13(23)19-11(12(21)22)8(6-26-15(17)24)7-28-14(16)19;/h2-4,14H,5-7H2,1H3,(H2,17,24)(H,18,20)(H,21,22);/q;+1/p-1/t14-,16+;/m1./s1/i1D3;
IUPAC
sodium;N-[(6R,7S)-3-(carbamoyloxymethyl)-2-carboxy-8-oxo-7-(trideuteriomethoxy)-5-thia-1-azabicyclo[4.2.0]oct-2-en-7-yl]-2-thiophen-2-ylethanimidate
SIL Type
Deuterium
Product Data
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Format
Neat