Chemical Properties of 3«beta»,7«beta»-Dihydroxy-5«beta»-cholanoic acid, MeTMS (CAS 78964-21-3)

3«beta»,7«beta»-Dihydroxy-5«beta»-cholanoic acid, MeTMS

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InChI
InChI=1S/C31H58O4Si2/c1-21(11-14-28(32)33-4)24-12-13-25-29-26(16-18-31(24,25)3)30(2)17-15-23(34-36(5,6)7)19-22(30)20-27(29)35-37(8,9)10/h21-27,29H,11-20H2,1-10H3/t21-,22+,23+,24-,25+,26+,27+,29+,30+,31-/m0/s1
InChI Key
FUVKOFYYHKWFJK-MLZFRZJBSA-N
Formula
C31H58O4Si2
SMILES
COC(=O)CCC(C)C1CCC2C3C(O[Si](C)(C)C)CC4CC(O[Si](C)(C)C)CCC4(C)C3CCC12C
Molecular Weight1
550.96
CAS
78964-21-3
Other Names
  • Isoursodeoxycholic acid, trimethylsilyl ether-methyl ester
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Physical Properties

Property Value Unit Source
log10WS -3.81 Crippen Calculated Property
logPoct/wat 8.285 Crippen Calculated Property
Inp [3268.00; 3316.00]   Show Hide
Inp 3268.00 NIST
Inp 3316.00 NIST
Inp 3268.00 NIST
Inp 3316.00 NIST
I [3687.00; 3687.00]   Show Hide
I 3687.00 NIST
I 3687.00 NIST

Similar Compounds

allo-Cholanic acid, 3«alpha»,7«alpha»-dihydroxy, Me-TMS. Cholanoic acid, 3,7-dihydroxy, methyl ester, TMS. 5«beta»-cholanoate,3«alpha»,7«alpha»-dihydroxy, methyl ester-trimethylsilyl ether. Isochenodeoxycholic acid, trimethylsilyl ether-methyl ester. allo-Cholanic acid, 3«beta»,7«beta»-dihydroxy, Me-TMS. allo-Cholanic acid, 3«beta»,7«alpha»-dihydroxy, Me-TMS. Ursodeoxycholic acid, trimethylsilyl ether-methyl ester. 3«beta»,7«alpha»-Dihydroxy-5«beta»-cholanoic acid, MeTMS. Chenodeoxycholic acid, trimethylsilyl ether-methyl ester. allo-Cholanic acid, 3«alpha»,7«beta»-dihydroxy, Me-TMS. 3«alpha»,7«beta»-Dihydroxy-5«beta»-homocholanoic acid, MeTMS. Homochenodeoxycholic acid, trimethylsilyl ether-methyl ester. Cholanic acid, 7«beta»-hydroxy, Me-TMS. allo-Cholanic acid, 7«beta»-hydroxy, Me-TMS. allo-Cholanic acid, 7«alpha»-hydroxy, Me-TMS.

Find more compounds similar to 3«beta»,7«beta»-Dihydroxy-5«beta»-cholanoic acid, MeTMS.

Sources

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