| SpectraBase Compound ID | 31SkHbSbf3u |
|---|---|
| InChI | InChI=1S/C35H60O3Si/c1-11-37-32(36)25(3)14-12-13-24(2)29-17-18-30-28-16-15-26-23-27(38-39(9,10)33(4,5)6)19-21-34(26,7)31(28)20-22-35(29,30)8/h14-15,24,27-31H,11-13,16-23H2,1-10H3/b25-14-/t24-,27+,28+,29-,30+,31+,34+,35-/m1/s1 |
| InChIKey | XVSXWIOJQPDKBO-NCTNCRQOSA-N |
| Mol Weight | 556.9 g/mol |
| Molecular Formula | C35H60O3Si |
| Exact Mass | 556.431172 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KG4J4I0N5aW |
|---|---|
| Name | Ethyl (24Z)-3B-(tert-butyldimethylsilyloxy) cholesta-5,24-dien-26-oate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 556.431172324 u |
| Formula | C35H60O3Si |
| InChI | InChI=1S/C35H60O3Si/c1-11-37-32(36)25(3)14-12-13-24(2)29-17-18-30-28-16-15-26-23-27(38-39(9,10)33(4,5)6)19-21-34(26,7)31(28)20-22-35(29,30)8/h14-15,24,27-31H,11-13,16-23H2,1-10H3/b25-14-/t24-,27+,28+,29-,30+,31+,34+,35-/m1/s1 |
| InChIKey | XVSXWIOJQPDKBO-NCTNCRQOSA-N |
| Molecular Weight | 556.947 g/mol |
| SMILES | C1[C@@](CC=2[C@](C1)([C@]1(CC[C@@]3(C)[C@@]([C@]1([H])CC2)([H])CC[C@@]3([C@@](CC\C=C/(C(=O)OCC)C)(C)[H])[H])[H])C)(O[Si](C)(C)C(C)(C)C)[H] |