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Prednisone acetate

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For Research Use Only | Not For Clinical Use
CATAPS125100
CAS125-10-0
Structure
SynonymsDelta1-Cortisone 21-acetate, Delcortin, Ferrosan, NSC 10965, Delta1-Dehydrocortisone acetate, 21-(Acetyloxy)-17-hydroxypregna-1,4-diene-3,11,20-trione, Nisone,Prednisone Acetate, 21-Acetoxy-17alpha-hydroxypregna-1,4-diene-3,11,20-trione, Deltalone, Delta-Corlin, Cortancyl, Prednisone 21-acetate, Prednisone acetate, 17,21-Dihydroxypregna-1,4-diene-3,11,20-trione 21-acetate
IUPAC Name[2-[(8S,9S,10R,13S,14S,17R)-17-hydroxy-10,13-dimethyl-3,11-dioxo-6,7,8,9,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate
Molecular Weight400.46
Molecular FormulaC23H28O6
Canonical SMILESCC(=O)OCC(=O)[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@H]3C(=O)C[C@]12C
InChIInChI=1S/C23H28O6/c1-13(24)29-12-19(27)23(28)9-7-17-16-5-4-14-10-15(25)6-8-21(14,2)20(16)18(26)11-22(17,23)3/h6,8,10,16-17,20,28H,4-5,7,9,11-12H2,1-3H3/t16-,17-,20+,21-,22-,23-/m0/s1
Accurate Mass400.1886
FormatNeat
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