(11β)-11,17-Dihydroxy-21-[(methylsulfonyl)oxy]pregna-1,4-diene-3,20-dione
CAS Registry Number®
35410-28-7
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CAS Name
(11β)-11,17-Dihydroxy-21-[(methylsulfonyl)oxy]pregna-1,4-diene-3,20-dioneMolecular Formula
C22H30O7SMolecular Mass
438.53Cite this Page
(11β)-11,17-Dihydroxy-21-[(methylsulfonyl)oxy]pregna-1,4-diene-3,20-dione. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=35410-28-7 (retrieved ) (CAS RN: 35410-28-7). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
206 °C (decomp)
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C22H30O7S/c1-20-8-6-14(23)10-13(20)4-5-15-16-7-9-22(26,18(25)12-29-30(3,27)28)21(16,2)11-17(24)19(15)20/h6,8,10,15-17,19,24,26H,4-5,7,9,11-12H2,1-3H3/t15-,16-,17-,19+,20-,21-,22-/m0/s1
InChIKey
InChIKey=TZEYKLAAPSZABE-CWNVBEKCSA-N
SMILES
C[C@@]12[C@]([C@]3([C@]([C@@H](O)C1)([C@]4(C)C(CC3)=CC(=O)C=C4)[H])[H])(CC[C@@]2(C(COS(C)(=O)=O)=O)O)[H]
Canonical SMILES
O=C1C=CC2(C(=C1)CCC3C4CCC(O)(C(=O)COS(=O)(=O)C)C4(C)CC(O)C32)C
Other Names for this Substance
- Pregna-1,4-diene-3,20-dione, 11,17-dihydroxy-21-[(methylsulfonyl)oxy]-, (11β)-
- Pregna-1,4-diene-3,20-dione, 11β,17,21-trihydroxy-, 21-methanesulfonate
- (11β)-11,17-Dihydroxy-21-[(methylsulfonyl)oxy]pregna-1,4-diene-3,20-dione
- Prednisolone 21-methanesulfonate