Chemical Properties of 1-«beta»,3-«alpha»,12-«alpha»-Trihydroxy-5-«beta»-cholanoic acid, MeTMS

1-«beta»,3-«alpha»,12-«alpha»-Trihydroxy-5-«beta»-cholanoic acid, MeTMS

PDF Excel Molecule Calculator
InChI
InChI=1S/C34H66O5Si3/c1-23(14-19-32(35)36-4)27-17-18-28-26-16-15-24-20-25(37-40(5,6)7)21-30(38-41(8,9)10)33(24,2)29(26)22-31(34(27,28)3)39-42(11,12)13/h23-31H,14-22H2,1-13H3/t23-,24-,25+,26?,27-,28?,29?,30-,31+,33+,34-/m0/s1
InChI Key
XULBSWSPHURKBG-DYXBISBCSA-N
Formula
C34H66O5Si3
SMILES
COC(=O)CCC(C)C1CCC2C3CCC4CC(O[Si](C)(C)C)CC(O[Si](C)(C)C)C4(C)C3CC(O[Si](C)(C)C)C12C
Molecular Weight1
639.14
Other Names
  • 5-«beta»-Cholanoic acid, 1-«beta»-3-«alpha»,12-«alpha»-trihydroxy, methyl ester, TMS
Cheméo is a service of Céondo GmbH, since 2007, we provide simulation, modelling and software development services for the industry. Do not hesitate to contact us for your projects.

Physical Properties

Property Value Unit Source
log10WS -2.31 Crippen Calculated Property
logPoct/wat 9.115 Crippen Calculated Property
Inp [3296.00; 3296.00]   Show Hide
Inp 3296.00 NIST
Inp 3296.00 NIST

Similar Compounds

Methyl 23-hydroxycholate tetrakis(trimethylsilyl)-. 1-«beta»,3-«alpha»,7-«beta»-Trihydroxy-5-«beta»-cholic acid, methyl ester, TMS. allo-Cholanic acid, 3«beta»,12«alpha»-dihydroxy, Me-TMS. Cholan-24-oic acid, 3,12-bis[(trimethylsilyl)oxy]-, methyl ester, (3«alpha»,5«beta»,12«alpha»)-. 3-«beta»,12-«alpha»-Dihydroxy-5-«alpha»-cholanoic acid, MeTMS. 3«alpha»,12«beta»-Dihydroxy-5«beta»-cholanoic acid, methyl ester-trimethylsilyl ether. allo-Cholanic acid, 3«beta»,12«beta»-dihydroxy, Me-TMS. Cholanic acid, 3«beta»,12«alpha»-dihydroxy, Me-TMS. Cholanic acid, 3«beta»,12«beta»-dihydroxy, Me-TMS. 3-«beta»,12-«alpha»-Dihydroxy-5-«beta»-cholanoic acid, MeTMS. allo-Cholanic acid, 3«alpha»,12«beta»-dihydroxy, Me-TMS. 3-«alpha»,12-«alpha»-Dihydroxy-5-«alpha»-cholanoic acid, MeTMS. 5-«alpha»-Cholanoic acid, 3-«alpha»-12-«beta»-dihydroxy, methyl ester, TMS. Cholanic acid, 3«alpha»,12«beta»-dihydroxy, Me-TMS. Cholanic acid, 3«alpha»,12«alpha»-dihydroxy, Me-TMS.

Find more compounds similar to 1-«beta»,3-«alpha»,12-«alpha»-Trihydroxy-5-«beta»-cholanoic acid, MeTMS.

Sources

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.