SpectraBase Spectrum ID |
9IaH0pNEM4R |
Name |
(8S,20S)-des-A,B-S-benzoyloxy-20-[(4R)-tert-butyldimethylsilyloxy-pentyl]pregnane |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C30H50O3Si |
InChI |
InChI=1S/C30H50O3Si/c1-22(14-12-15-23(2)33-34(7,8)29(3,4)5)25-19-20-26-27(18-13-21-30(25,26)6)32-28(31)24-16-10-9-11-17-24/h9-11,16-17,22-23,25-27H,12-15,18-21H2,1-8H3/t22-,23+,25+,26-,27-,30+/m0/s1 |
InChIKey |
LYWLZVGPNNAUCH-SQPHFEDLSA-N |
Instrument Name |
Kratos DS-50 TC |
Ionization Type |
EI |
Molecular Weight |
486.812 g/mol |
Optical Rotation |
[a]D = +10.8 (c = 1.3, CHCl3) |
SMILES |
C1C[C@@]([C@]2([C@](C1)([C@](CC2)([C@](CCC[C@@](C)(O[Si](C(C)(C)C)(C)C)[H])(C)[H])[H])C)[H])(OC(c1ccccc1)=O)[H] |
SPLASH |
splash10-06sj-0910000000-49f26ec748adbed72c99 |
Source of Spectrum |
EP2240463A2 |
Wiley ID |
1843943 |