3β,7α-Dihydroxy-4-cholenic acid, methyl ester, TMS

Formula: C₃₁H₅₆O₄Si₂
Molecular weight: 548.9449
IUPAC Standard InChI: InChI=1S/C31H56O4Si2/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/h19,21,23-27,29H,11-18,20H2,1-10H3/t21-,23+,24-,25+,26+,27-,29+,30+,31-/m0/s1
IUPAC Standard InChIKey: KHYMDYRSKURYAZ-WKKSCJTISA-N
Chemical structure:
This structure is also available as a 2d Mol file
Stereoisomers:
- 3-β,7-α-Dihydroxy-4-cholenoic acid, methyl ester, TMS
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Gas Chromatography

Data compiled by: NIST Mass Spectrometry Data Center, William E. Wallace, director

Normal alkane RI, non-polar column, isothermal

Column type	Active phase	Temperature (C)	I	Reference	Comment
Capillary	OV-1	275.	3200.	Lawson and Setchell, 1988	18. m/0.20 mm/0.25 μm, He
Capillary	OV-1	275.	3204.	Lawson and Setchell, 1988	18. m/0.20 mm/0.25 μm, He

References

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Lawson and Setchell, 1988
Lawson, A.M.; Setchell, K.D.R., Appendix of GC retention indices. List of retention indices foe methyl ester - trimethylsilyl (Me-TMS) ether derivatives of bile acids, The Bile Acids. Vol. 4, Methods and Applications, 1988, 4, 571-575. [all data]

Notes

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Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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