| SpectraBase Compound ID | KCJIqdHT9tJ |
|---|---|
| InChI | InChI=1S/C33H58O4SSi/c1-23(12-10-18-32(5,6)34)28-16-17-29-24(13-11-19-33(28,29)7)20-30-27-21-26(37-39(8,9)31(2,3)4)15-14-25(27)22-38(30,35)36/h20,23,26,28-30,34H,10-19,21-22H2,1-9H3/b24-20+/t23-,26-,28?,29?,30?,33?/m1/s1 |
| InChIKey | TVNBINWIIVAEQD-KVAWBRIRSA-N |
| Mol Weight | 579.0 g/mol |
| Molecular Formula | C33H58O4SSi |
| Exact Mass | 578.382508 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | HboHIDStVPH |
|---|---|
| Name | (6S) Sulfonyl Adduct of -(5Z,7E)-3-(tert-Butyldimethylsilyloxy)-9,10-seco-5,7,10(19)-cholestatriene-1-ol |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C33H58O4SSi |
| InChI | InChI=1S/C33H58O4SSi/c1-23(12-10-18-32(5,6)34)28-16-17-29-24(13-11-19-33(28,29)7)20-30-27-21-26(37-39(8,9)31(2,3)4)15-14-25(27)22-38(30,35)36/h20,23,26,28-30,34H,10-19,21-22H2,1-9H3/b24-20+/t23-,26-,28?,29?,30?,33?/m1/s1 |
| InChIKey | TVNBINWIIVAEQD-KVAWBRIRSA-N |
| Molecular Weight | 578.968 g/mol |
| SMILES | OC(CCC[C@](C1C2(C(\C(=C\C3S(CC=4CC[C@@](O[Si](C(C)(C)C)(C)C)(CC34)[H])(=O)=O)CCC2)CC1)C)(C)[H])(C)C |
| SPLASH | splash10-06si-0736950000-1a53156c6e8f193e909d |
| Source of Spectrum | E2-48-1489-6 |
| Wiley ID | 1555275 |