![Cholan-24-oic acid, 3,12-bis[(trimethylsilyl)oxy]-, methyl ester, (3.alpha.,5.beta.,12.alpha.)-](/api/spectrum/HEkgpBorX8e/structure.png?h=300&w=458 "Cholan-24-oic acid, 3,12-bis[(trimethylsilyl)oxy]-, methyl ester, (3.alpha.,5.beta.,12.alpha.)-")
| SpectraBase Compound ID | IIUXBL3gnkt |
|---|---|
| InChI | InChI=1S/C31H58O4Si2/c1-21(11-16-29(32)33-4)25-14-15-26-24-13-12-22-19-23(34-36(5,6)7)17-18-30(22,2)27(24)20-28(31(25,26)3)35-37(8,9)10/h21-28H,11-20H2,1-10H3 |
| InChIKey | RDYDEBUPRPMEHW-UHFFFAOYSA-N |
| Mol Weight | 551.0 g/mol |
| Molecular Formula | C31H58O4Si2 |
| Exact Mass | 550.387363 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | HEkgpBorX8e |
|---|---|
| Name | Cholan-24-oic acid, 3,12-bis[(trimethylsilyl)oxy]-, methyl ester, (3.alpha.,5.beta.,12.alpha.)- |
| CAS Registry Number | 6818-41-3 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C31H58O4Si2 |
| InChI | InChI=1S/C31H58O4Si2/c1-21(11-16-29(32)33-4)25-14-15-26-24-13-12-22-19-23(34-36(5,6)7)17-18-30(22,2)27(24)20-28(31(25,26)3)35-37(8,9)10/h21-28H,11-20H2,1-10H3 |
| InChIKey | RDYDEBUPRPMEHW-UHFFFAOYSA-N |
| Molecular Weight | 550.971 g/mol |
| SMILES | CC12C(C3C(CC2O[Si](C)(C)C)C2(C)C(CC3)CC(CC2)O[Si](C)(C)C)CCC1C(CCC(OC)=O)C |
| SPLASH | splash10-0ab9-9562000000-66ea8ff27bcf22ea3e88 |
| Source of Spectrum | JZ-1992-3026-0 |
| Synonyms | 4-[10,13-dimethyl-3,12-bis(trimethylsilyloxy)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid methyl ester 4-[10,13-dimethyl-3,12-bis(trimethylsilyloxy)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]valeric acid methyl ester 5.beta.-Cholanic acid, 3.alpha.,12.alpha.-bis(trimethylsiloxy)-, methyl ester Methyl 4-[10,13-dimethyl-3,12-bis(trimethylsilyloxy)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoate |
| Wiley ID | 1405743 |