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Prednisolone pivalate

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For Research Use Only | Not For Clinical Use
CATAPS1107999
CAS1107-99-9
Structure
SynonymsPrednisolone 21-trimethylacetate,Prednisolone Pivalate, PTMA, Ultracorterenol, Mecortolon, 11beta,17alpha-Dihydroxy-21-pivaloyloxypregna-1,4-diene-3,20-dione, (11beta)-21-(2,2-Dimethyl-1-oxopropoxy)-11,17-dihydroxypregna-1,4-diene-3,20-dione, Prednisolone pivalate, Ultracortenol, Prednisolone trimethylacetate, 11beta,17,21-Trihydroxypregna-1,4-diene-3,20-dione 21-pivalate, Vecortenol
IUPAC Name[2-[(8S,9S,10R,11S,13S,14S,17R)-11,17-dihydroxy-10,13-dimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] 2,2-dimethylpropanoate
Molecular Weight444.56
Molecular FormulaC26H36O6
Canonical SMILESCC(C)(C)C(=O)OCC(=O)[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@H]3[C@@H](O)C[C@]12C
InChIInChI=1S/C26H36O6/c1-23(2,3)22(30)32-14-20(29)26(31)11-9-18-17-7-6-15-12-16(27)8-10-24(15,4)21(17)19(28)13-25(18,26)5/h8,10,12,17-19,21,28,31H,6-7,9,11,13-14H2,1-5H3/t17-,18-,19-,21+,24-,25-,26-/m0/s1
Accurate Mass444.2512
FormatNeat
TypeAPI
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