Chemical Properties of 3«alpha»,4«beta», 7«alpha»-trihydroxy-5«beta»-cholanoic acid, methyl ester-trimethylsilyl-ether derivative

3«alpha»,4«beta», 7«alpha»-trihydroxy-5«beta»-cholanoic acid, methyl ester-trimethylsilyl-ether derivative

InChI
InChI=1S/C34H66O5Si3/c1-23(14-17-30(35)36-4)24-15-16-25-31-26(18-20-33(24,25)2)34(3)21-19-28(37-40(5,6)7)32(39-42(11,12)13)27(34)22-29(31)38-41(8,9)10/h23-29,31-32H,14-22H2,1-13H3/t23?,24-,25?,26?,27-,28-,29-,31?,32-,33-,34-/m0/s1
InChI Key
XLJGJNLLTFGMTL-OLPRANIPSA-N
Formula
C34H66O5Si3
SMILES
COC(=O)CCC(C)C1CCC2C3C(O[Si](C)(C)C)CC4C(O[Si](C)(C)C)C(O[Si](C)(C)C)CCC4(C)C3CCC12C
Molecular Weight1
639.14
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Physical Properties

Property Value Unit Source
log10WS -6.95 Relay (1.0) Calculated Property
logPoct/wat 9.115 Crippen Calculated Property
Inp [3384.00; 3384.00]   Show Hide
Inp 3384.00 NIST
Inp 3384.00 NIST
Inp 3384.00 NIST
Tfus 382.79 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal Boiling Point Temperature, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Similar Compounds

5-«beta»-Cholanoic acid, 3-«alpha»,4-«beta»,7-«alpha»-trihydroxy, methyl ester, TMS. 3-«alpha»,4-«xi»,7-«beta»-Trihydroxy-5-«beta»-cholic acid, methyl ester, TMS. 3«beta»,4«beta», 7«alpha»-trihydroxy-5«beta»-cholanoic acid, methyl ester-trimethylsilyl-ether derivative. Cholanic acid, 3«alpha»,6«alpha»,7«alpha»-trihydroxy, Me-TMS. 3«alpha»,6«beta»,7«beta»-Trihydroxy-5«beta»-cholanoic acid, MeTMS. 3-«alpha»,6-«alpha»,7-«beta»-Trihydroxy-5-«beta»-cholic acid, methyl ester, TMS. Hyocholic acid, trimethyl ether-methyl ester. «alpha»-Muricholic acid, trimethyl ether-methyl ester. 3«alpha»,4«beta»-dihydroxy-5«beta»-cholanoic acid, methyl ester-trimethylsilyl-ether derivative. 3«beta»,4«beta»-dihydroxy-5«beta»-cholanoic acid, methyl ester-trimethylsilyl-ether derivative. 5-«beta»-Cholanoic acid, 3-«alpha»,4-«beta»,7-«alpha»,12-«alpha»-tetrahydroxy, methyl ester, TMS. 3«beta»,4«beta»,7«alpha»,12«alpha»-tetrahydroxy-5«beta»-cholanoic acid, methyl ester-trimethylsilyl-ether derivative. 3-«alpha»,4-«beta»,7-«alpha»,12-«alpha»-Tetrahydroxy-5-«alpha»-cholanoic acid, MeTMS. 3«alpha»,4«beta»,7«alpha»,12«alpha»-tetrahydroxy-5«beta»-cholanoic acid, methyl ester-trimethylsilyl-ether derivative. 5-«alpha»-Cholanoic acid, 3-«alpha»-6-«alpha»,7-«alpha»,12-«alpha»-tetrahydroxy, methyl ester, TMS.

Find more compounds similar to 3«alpha»,4«beta», 7«alpha»-trihydroxy-5«beta»-cholanoic acid, methyl ester-trimethylsilyl-ether derivative.

Sources

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