Chemical Properties of 3«alpha»,7«alpha»,12«alpha»-trihydroxy-5«beta»-C29-dioic bile acid, methyl ester, TMS

3«alpha»,7«alpha»,12«alpha»-trihydroxy-5«beta»-C29-dioic bile acid, methyl ester, TMS

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InChI
InChI=1S/C40H76O7Si3/c1-27(16-15-17-28(38(42)44-5)18-21-36(41)43-4)31-19-20-32-37-33(26-35(40(31,32)3)47-50(12,13)14)39(2)23-22-30(45-48(6,7)8)24-29(39)25-34(37)46-49(9,10)11/h27-35,37H,15-26H2,1-14H3/t27-,28?,29+,30-,31-,32?,33+,34-,35+,37?,39+,40-/m0/s1
InChI Key
VDYGYVATAXFXJX-HNODWYMFSA-N
Formula
C40H76O7Si3
SMILES
COC(=O)CCC(CCCC(C)C1CCC2C3C(O[Si](C)(C)C)CC4CC(O[Si](C)(C)C)CCC4(C)C3CC(O[Si](C)(C)C)C12C)C(=O)OC
Molecular Weight1
753.28
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Physical Properties

Property Value Unit Source
log10WS -3.45 Crippen Calculated Property
logPoct/wat 10.074 Crippen Calculated Property
Inp [3930.00; 3930.00]   Show Hide
Inp 3930.00 NIST
Inp 3930.00 NIST

Similar Compounds

3«alpha»,7«alpha»,12«alpha»-trihydroxy-5«beta»-C27-bile acid, methyl ester, TMS. 3«alpha»,7«alpha»,12«alpha»-trihydroxy, 5«alpha»-cholestanoate, methyl ester-trimethylsilyl ether. 3-«alpha»,7-«alpha»,12-«alpha»-Trihydroxy-5-«beta»-cholestanoic acid, methyl ester, TMS. 3«alpha»,7«alpha»,12«alpha»-trihydroxy, 5«beta»-cholestanoate, methyl ester-trimethylsilyl ether. 3-«alpha»,7-«alpha»-Dihydroxy-5-«beta»-cholestanoic acid, methyl ester, TMS. 3«alpha»,7«alpha»-dihydroxy-5«beta»-C27-bile acid, methyl ester, TMS. Cholanic acid, 3«alpha»,7«alpha»,12«alpha»-trihydroxy, Me-TMS. allo-Cholanic acid, 3«alpha»,7«beta»,12«alpha»-trihydroxy, Me-TMS. Cholanic acid, 3«beta»,7«alpha»,12«alpha»-trihydroxy, Me-TMS. allo-Cholanic acid, 3«alpha»,7«alpha»,12«alpha»-trihydroxy, Me-TMS. Cholan-24-oic acid, 3,7,12-tris[(trimethylsilyl)oxy]-, methyl ester, (3«alpha»,5«beta»,7«alpha»,12«alpha»)-. 3«alpha»,7«alpha»,12«alpha»-Trihydroxy-5«beta»-homocholanoic acid, MeTMS. 3«alpha»,12«alpha»-Dihydroxy-5«beta»-cholanoic acid, methyl ester-trimethylsilyl ether. Cholanic acid, 3«alpha»,7«alpha»,12«beta»-trihydroxy, Me-TMS. 3«alpha»,7«alpha»,12«beta»-Trihydroxy-5«beta»-cholanoic acid, methyl ester-trimethylsilyl ether.

Find more compounds similar to 3«alpha»,7«alpha»,12«alpha»-trihydroxy-5«beta»-C29-dioic bile acid, methyl ester, TMS.

Sources

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