![3.beta.,26-bis[(t-Butyldimethyl)silyloxy]-cholest-5-en-7-one](/api/spectrum/KdVVEdjRtmB/structure.png?h=300&w=458 "3.beta.,26-bis[(t-Butyldimethyl)silyloxy]-cholest-5-en-7-one")
| SpectraBase Compound ID | 61OI3mZlKjO |
|---|---|
| InChI | InChI=1S/C39H72O3Si2/c1-27(26-41-43(11,12)36(3,4)5)16-15-17-28(2)31-18-19-32-35-33(21-23-39(31,32)10)38(9)22-20-30(24-29(38)25-34(35)40)42-44(13,14)37(6,7)8/h25,27-28,30-33,35H,15-24,26H2,1-14H3/t27?,28-,30+,31-,32+,33+,35+,38+,39-/m1/s1 |
| InChIKey | VOJVDYWCZMNQJC-IWOKEJCWSA-N |
| Mol Weight | 645.2 g/mol |
| Molecular Formula | C39H72O3Si2 |
| Exact Mass | 644.501999 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KdVVEdjRtmB |
|---|---|
| Name | 3.beta.,26-bis[(T-Butyldimethyl)silyloxy]-cholest-5-en-7-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 644.501999245 u |
| Formula | C39H72O3Si2 |
| InChI | InChI=1S/C39H72O3Si2/c1-27(26-41-43(11,12)36(3,4)5)16-15-17-28(2)31-18-19-32-35-33(21-23-39(31,32)10)38(9)22-20-30(24-29(38)25-34(35)40)42-44(13,14)37(6,7)8/h25,27-28,30-33,35H,15-24,26H2,1-14H3/t27?,28-,30+,31-,32+,33+,35+,38+,39-/m1/s1 |
| InChIKey | VOJVDYWCZMNQJC-IWOKEJCWSA-N |
| Molecular Weight | 645.172 g/mol |
| SMILES | [C@@]12([C@]([C@@]3(C(C=C4[C@@]([C@]3(CC2)[H])(CC[C@](O[Si](C(C)(C)C)(C)C)(C4)[H])C)=O)[H])(CC[C@@]1([C@@](CCCC(CO[Si](C(C)(C)C)(C)C)C)(C)[H])[H])[H])C |