SpectraBase Spectrum ID |
22xRnm42ofz |
Name |
9,10-Secochola-5,7,10(19)-trien-24-one, 24-cyclopropyl-1,3-bis[[(1,1-dimethylethyl)dimethylsilyl]oxy]-, (1.alpha.,3.beta.,5E,7E)- |
CAS Registry Number |
112849-23-7 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C39H68O3Si2 |
InChI |
InChI=1S/C39H68O3Si2/c1-27(16-23-35(40)30-18-19-30)33-21-22-34-29(15-14-24-39(33,34)9)17-20-31-25-32(41-43(10,11)37(3,4)5)26-36(28(31)2)42-44(12,13)38(6,7)8/h17,20,27,30,32-34,36H,2,14-16,18-19,21-26H2,1,3-13H3/b29-17+,31-20+/t27?,32?,33?,34-,36?,39+/m0/s1 |
InChIKey |
FOJVNMQZRKYOTJ-NUPWIJPPSA-N |
Molecular Weight |
641.140 g/mol |
SMILES |
[C@]12([C@](\C(=C\C=C\3C(C(O[Si](C(C)(C)C)(C)C)CC(C3)O[Si](C(C)(C)C)(C)C)=C)CCC1)(CCC2C(CCC(C1CC1)=O)C)[H])C |
SPLASH |
splash10-0002-0090031000-a3864b6b878521e2cee6 |
Source of Spectrum |
F-43-4616-19 |
Synonyms |
(5E,7E)-1,3-bis{[tert-butyl(dimethyl)silyl]oxy}-24-cyclopropyl-9,10-secochola-5,7,10-trien-24-one
1(S),3(R)-bis(t-butyldimethylsilyloxy)-20(R)-(3'-cyclopropyl-3'-oxopropyl)-9,10-secopregna-5(E),7(E),10(19)-triene |
Wiley ID |
1412660 |