| SpectraBase Compound ID | 1X1V3XywMFQ |
|---|---|
| InChI | InChI=1S/C28H54O3Si3/c1-27-16-14-21(29-32(3,4)5)18-20(27)19-24(30-33(6,7)8)26-22-12-13-25(31-34(9,10)11)28(22,2)17-15-23(26)27/h19,21-26H,12-18H2,1-11H3/t21-,22-,23-,24+,25-,26-,27-,28-/m0/s1 |
| InChIKey | YZJWSRYSQHTCFY-MGZBTXGZSA-N |
| Mol Weight | 523.0 g/mol |
| Molecular Formula | C28H54O3Si3 |
| Exact Mass | 522.338075 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KX3cw5f33EM |
|---|---|
| Name | Tristrimethylsilyl 3.beta.,7.alpha.,17.beta.-trihydroxy-androst-5-ene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 522.338075201 u |
| Formula | C28H54O3Si3 |
| InChI | InChI=1S/C28H54O3Si3/c1-27-16-14-21(29-32(3,4)5)18-20(27)19-24(30-33(6,7)8)26-22-12-13-25(31-34(9,10)11)28(22,2)17-15-23(26)27/h19,21-26H,12-18H2,1-11H3/t21-,22-,23-,24+,25-,26-,27-,28-/m0/s1 |
| InChIKey | YZJWSRYSQHTCFY-MGZBTXGZSA-N |
| Molecular Weight | 522.992 g/mol |
| SMILES | [C@]12(C(=C[C@]([C@]3([C@@]4(CC[C@@]([C@]4(CC[C@]23[H])C)(O[Si](C)(C)C)[H])[H])[H])(O[Si](C)(C)C)[H])C[C@@](O[Si](C)(C)C)(CC1)[H])C |