Chemical Properties of Cholan-24-oic acid, 3,12-bis[(trimethylsilyl)oxy]-, methyl ester, (3«alpha»,5«beta»,12«alpha»)- (CAS 6818-41-3)

Cholan-24-oic acid, 3,12-bis[(trimethylsilyl)oxy]-, methyl ester, (3«alpha»,5«beta»,12«alpha»)-

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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
InChI Key
RDYDEBUPRPMEHW-UHFFFAOYSA-N
Formula
C31H58O4Si2
SMILES
COC(=O)CCC(C)C1CCC2C3CCC4CC(O[Si](C)(C)C)CCC4(C)C3CC(O[Si](C)(C)C)C12C
Molecular Weight1
550.96
CAS
6818-41-3
Other Names
  • 3-«alpha»,12-«alpha»-Dihydroxy-5-«beta»-cholanoic acid, MeTMS
  • 5-«beta»-Cholanoic acid, 3-«alpha»-12-«alpha»-dihydroxy, methyl ester, TMS
  • 5«beta»-Cholanic acid, 3«alpha»,12«alpha»-bis(trimethylsiloxy)-, methyl ester
  • Deoxycholic acid, trimethylsilyl ether-methyl ester
  • Methyl 3,12-bis[(trimethylsilyl)oxy]cholan-24-oate, (3«alpha»,5«beta»,12«alpha»)-
  • Methyl desoxycholate, 2tms derivative
Sources

Physical Properties

Property Value Unit Source
logPoct/wat 8.28 Crippen Calculated Property

Similar Compounds

Cholanic acid, 3«beta»,12«alpha»-dihydroxy, Me-TMS. allo-Cholanic acid, 3«alpha»,12«alpha»-dihydroxy, Me-TMS. 5-«alpha»-Cholanoic acid, 3-«alpha»-12-«beta»-dihydroxy, methyl ester, TMS. allo-Cholanic acid, 3«beta»,12«beta»-dihydroxy, Me-TMS. Cholanic acid, 12«alpha»-hydroxy, Me-TMS. Cholanic acid, 3«alpha»,12«alpha»-dihydroxy, Me-TMS. 3-«alpha»,12-«alpha»-Dihydroxy-5-«alpha»-cholanoic acid, MeTMS. allo-Cholanic acid, 3«alpha»,12«beta»-dihydroxy, Me-TMS. Cholanic acid, 3«beta»,12«beta»-dihydroxy, Me-TMS. allo-Cholanic acid, 3«beta»,12«alpha»-dihydroxy, Me-TMS. allo-Cholanic acid, 12«alpha»-hydroxy, Me-TMS. Cholanic acid, 3«alpha»,12«beta»-dihydroxy, Me-TMS. 3«alpha»,12«beta»-Dihydroxy-5«beta»-cholanoic acid, methyl ester-trimethylsilyl ether. 12«alpha»-Hydroxy-5«alpha»-cholanic acid, methyl ester, TMS. 3-«beta»,12-«alpha»-Dihydroxy-5-«alpha»-cholanoic acid, MeTMS.

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