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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)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KYnnuu0HULt
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 splash10-0ab9-9651000000-ab14c4cbec11843f55fa
Source of Spectrum EP-8487-0-0
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 1405742