SpectraBase Spectrum ID |
LSrwaPlsLCY |
Name |
3-{[TERT-BUTYL(DIMETHYL)SILYL]OXY}-17-HYDROXYPREGNA-3,5-DIEN-20-ONE |
Copyright |
Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
444.305971809 u |
Formula |
C27H44O3Si |
InChI |
InChI=1S/C27H44O3Si/c1-18(28)27(29)16-13-23-21-10-9-19-17-20(30-31(7,8)24(2,3)4)11-14-25(19,5)22(21)12-15-26(23,27)6/h9,17,21-23,29H,10-16H2,1-8H3/t21-,22+,23+,25+,26+,27+/m1/s1 |
InChIKey |
NXWLOEKJXQYUBM-LJHIYBGHSA-N |
Molecular Weight |
444.731 g/mol |
Nominal Mass |
444 u |
Number of Peaks |
154 |
SMILES |
O[C@@]1(CC[C@]2([C@@]3(CC=C4C=C(CC[C@@]4([C@]3(CC[C@]12C)[H])C)O[Si](C)(C)C(C)(C)C)[H])[H])C(C)=O |
SPLASH |
splash10-006x-9510300000-aa67e3f79a195592e0a6 |
Source File Reference |
LMCM-71357-665K |
Source of Spectrum |
Prof. D. Henneberg, MPI f. Kohlenforschung, Muelheim a.d.R., Germany |
Synonyms |
ANDROSTA-3,5-DIEN-3,17-DIOL, 17-ACETYL-3-O-(TERT.BUTYLDIMETHYLSILYL)-
1-[(1S,2R,10R,11S,14R,15S)-5-[(tert-butyldimethylsilyl)oxy]-14-hydroxy-2,15-dimethyltetracyclo[8.7.0.0(2,7).0(11,15)]heptadeca-5,7-dien-14-yl]ethan-1-one |
Wiley ID |
8_36365 |