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Betamethasone 21-Propionate D5

ISO 17034:

Chemical Name : Betamethasone 21-Propionate D5
Catalog Number : CS-O-14061
CAS Number : 75883-07-7(Unlabeled)
Status : Available for Dispatch by 28-Mar-2023
Category : Betamethasone Stable Isotopes
Purity : >98%
Molecular Weight : 453.56 mol/g
Molecular Formula : C25H28D5FO6
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Status : Betamethasone 21-Propionate D5 - Available for Dispatch by 28-Mar-2023
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More Information

Application : "Labeled Betamethasone, intended for use as an internal standard for the quantification of Betamethasone by GC- or LC-mass spectrometry. "
Chemical Name : (11β;16β)-9-Fluoro-11;17-dihydroxy-16-methyl-21-(1-oxopropoxy)pregna-1;4-diene-3;20-dione-d5.
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References : "Andersson; P,; et al,: J, Pharm, Pharmacol,; 36; 763 (1984); Wurthwein; G,; et al,: Biopharm, Drug Dispos,; 11; 381 (1990); Samtani; M,; et al,: J, Pharm, Sci,; 93; 726 (2004); Samtani; M,; et al,: Drug Metab, Dispos,; 33; 1124 (2005);"
Canonical SMILES : CCC(=O)OCC(=O)C1(C(CC2C1(CC(C3(C2CCC4=CC(=O)C=CC43C)F)O)C)C)O
Isomeric SMILES : CCC(=O)OCC(=O)[C@]1([C@H](C[C@@H]2[C@@]1(C[C@@H]([C@]3([C@H]2CCC4=CC(=O)C=C[C@@]43C)F)O)C)C)O
InChI : InChI=1S/C25H33FO6/c1-5-21(30)32-13-20(29)25(31)14(2)10-18-17-7-6-15-11-16(27)8-9-22(15,3)24(17,26)19(28)12-23(18,25)4/h8-9,11,14,17-19,28,31H,5-7,10,12-13H2,1-4H3/t14-,17-,18-,19-,22-,23-,24-,25-/m0/s1
IUPAC Name : [2-[(8S,9R,10S,11S,13S,14S,16S,17R)-9-fluoro-11,17-dihydroxy-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] propanoate
Exact Mass : 448.22611693
EC Number : 641-856-0