Chemical Properties of 3«alpha»,7«alpha»,12«alpha»,24(«epsilon»)-tetrahydroxy-5«beta»-cholestanoate, methyl ester-trimethylsilyl ether

3«alpha»,7«alpha»,12«alpha»,24(«epsilon»)-tetrahydroxy-5«beta»-cholestanoate, methyl ester-trimethylsilyl ether

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InChI
InChI=1S/C40H80O6Si4/c1-27(18-21-34(44-48(9,10)11)28(2)38(41)42-5)31-19-20-32-37-33(26-36(40(31,32)4)46-50(15,16)17)39(3)23-22-30(43-47(6,7)8)24-29(39)25-35(37)45-49(12,13)14/h27-37H,18-26H2,1-17H3/t27?,28?,29-,30+,31+,32?,33?,34?,35+,36-,37?,39-,40+/m1/s1
InChI Key
OFLKYCRDARMXPS-LFLLTUNISA-N
Formula
C40H80O6Si4
SMILES
COC(=O)C(C)C(CCC(C)C1CCC2C3C(O[Si](C)(C)C)CC4CC(O[Si](C)(C)C)CCC4(C)C3CC(O[Si](C)(C)C)C12C)O[Si](C)(C)C
Molecular Weight1
769.40
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Physical Properties

Property Value Unit Source
ω 0.9777 Relay (... Calculated Property
ΔfG° -268.73 kJ/mol Relay (... Calculated Property ⚠️
ΔfH°gas -1814.51 kJ/mol Relay (... Calculated Property
ΔvapH° 137.22 kJ/mol Relay (... Calculated Property
IE 8.94 eV Relay (... Calculated Property
log10WS -7.51 Relay (... Calculated Property
logPoct/wat 10.971 Crippen Calculated Property
Pc -1354.89 kPa Relay (... Calculated Property ⚠️
Inp 3605.00 NIST
Tboil 774.09 K Relay (... Calculated Property
Tc 1048.45 K Relay (... Calculated Property
Tfus 378.33 K Relay (... Calculated Property
Vc 2.467 m3/kmol Relay (... Calculated Property

Similar Compounds

3«alpha»,7«alpha»,12«alpha»,24-tetrahydroxy-5««beta»'»-C27-bile acid, methyl ester, TMS. 3«alpha»,7«alpha»,12«alpha»,26-tetrahydroxy-5«beta»-C27-bile acid, methyl ester, TMS. 3«alpha»,7«alpha»,12«alpha»,26-tetrahydroxy-5«beta»-cholestanoate, methyl ester-trimethylsilyl ether. 3«alpha»,7«alpha»,12«alpha»-trihydroxy, 5«beta»-cholestanoate, methyl ester-trimethylsilyl ether. 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-«beta»,22-Trihydroxy-5-«beta»-cholic acid, methyl ester, TMS. 3«alpha»,7«alpha»,12«alpha»-trihydroxy-5«beta»-C29-dioic bile acid, methyl ester, TMS. GA41, MeTMS. GA42, MeTMS. GA83, MeTMS. 3«alpha»,7«alpha»-dihydroxy-5«beta»-C27-bile acid, methyl ester, TMS. 3-«alpha»,7-«alpha»-Dihydroxy-5-«beta»-cholestanoic acid, methyl ester, TMS. 3«alpha»,7«alpha»,12«alpha»-Trihydroxy-5«beta»-homocholanoic acid, MeTMS.

Find more compounds similar to 3«alpha»,7«alpha»,12«alpha»,24(«epsilon»)-tetrahydroxy-5«beta»-cholestanoate, methyl ester-trimethylsilyl ether.

Sources

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