SpectraBase Spectrum ID |
26pzCxlFzE7 |
Name |
3aH-Indene-3a-carboxylic acid, 4-[(2,5-dimethoxyphenyl)methyl]-1-[2-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-1-methylethyl]octahydro-4-hydroxy-, methyl ester, [1.alpha.(R*),3a.alpha.,4.alpha.,7a.beta.]-(.+-.)- |
CAS Registry Number |
112946-34-6 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C29H48O6Si |
InChI |
InChI=1S/C29H48O6Si/c1-20(19-35-36(8,9)27(2,3)4)23-14-16-29(26(30)34-7)24(23)11-10-15-28(29,31)18-21-17-22(32-5)12-13-25(21)33-6/h12-13,17,20,23-24,31H,10-11,14-16,18-19H2,1-9H3/t20?,23-,24-,28+,29-/m1/s1 |
InChIKey |
PVNJNACUSQUQSW-XCOYSWOLSA-N |
Molecular Weight |
520.782 g/mol |
SMILES |
O[C@]1([C@]2([C@@]([C@@](C(CO[Si](C(C)(C)C)(C)C)C)(CC2)[H])(CCC1)[H])C(=O)OC)Cc1c(ccc(c1)OC)OC |
SPLASH |
splash10-0udi-2900000000-deb56fe3dfb6cd675421 |
Source of Spectrum |
C-111-7516-69 |
Synonyms |
Methyl (1S,3aS,4S,7aR)-1-(2-{[tert-butyl(dimethyl)silyl]oxy}-1-methylethyl)-4-(2,5-dimethoxybenzyl)-4-hydroxyoctahydro-3aH-indene-3a-carboxylate
rel-(1S,3aR,4R,7aS)-methyl 1-[2-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-1(S)-methylethyl]1,2,3,4,5,6,7,7a-octahydro-4-hydroxy-4-[(2,5-dimethoxyphenyl)methyl]-3ah-indene-1-carboxylate |
Wiley ID |
1401975 |