SpectraBase Spectrum ID |
238sdKyxTE |
Name |
(8S,20R)-Des-A,B-20-(1',1'-dimethyl-3'-ethoxycarbonyl-allyl)-8.beta.-[(triethylsilyl)oxy]-pregnane |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C26H48O3Si |
InChI |
InChI=1S/C26H48O3Si/c1-9-28-24(27)17-19-25(6,7)20(5)21-15-16-22-23(14-13-18-26(21,22)8)29-30(10-2,11-3)12-4/h17,19-23H,9-16,18H2,1-8H3/t20-,21-,22+,23+,26-/m1/s1 |
InChIKey |
ZOGDKYUUFFQKCB-YLGSOMAFSA-N |
Instrument Name |
Micromass AutoSpec |
Ionization Type |
EI |
Literature Reference DOI |
10.1021/jm300187x |
Molecular Weight |
436.752 g/mol |
Optical Rotation |
[a]D = +18.1 (c = 1.0, CHCl3) |
Reported Formula |
C26H48O3Si |
SMILES |
C1C[C@]2([C@]([C@](C1)(O[Si](CC)(CC)CC)[H])(CC[C@@]2([C@@](C)(C(C)(C)C=CC(OCC)=O)[H])[H])[H])C |
SPLASH |
splash10-002f-0890000000-6078dce971ac54754dc5 |
Source of Spectrum |
AF-55-SM10-32 |
Wiley ID |
1852060 |