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Chenodeoxycholic acid-Sulfate (CDCA-S)

Compound with spectra: 1 MS (LC)

Chenodeoxycholic acid-Sulfate (CDCA-S)
SpectraBase Compound ID JCpZpndIZjJ
InChI InChI=1S/C24H40O7S/c1-14(4-7-21(26)27)17-5-6-18-22-19(9-11-24(17,18)3)23(2)10-8-16(25)12-15(23)13-20(22)31-32(28,29)30/h14-20,22,25H,4-13H2,1-3H3,(H,26,27)(H,28,29,30)/t14-,15+,16-,17-,18+,19+,20-,22+,23+,24-/m1/s1
InChIKey DPVCTIYTPXYDMQ-BSWAIDMHSA-N
Mol Weight 472.6 g/mol
Molecular Formula C24H40O7S
Exact Mass 472.249475 g/mol
Enantiomer InChIKey DPVCTIYTPXYDMQ-MKELMWJVSA-N

View Spectrum of Chenodeoxycholic acid-Sulfate (CDCA-S)

MS (LC) Spectrum
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  • 3alpha,7alpha-Dihydroxy-5beta-cholan-24-oic acid 7-sulfate
3α,7α-dihydroxy-5β-cholan-24-oic acid, methyl ester, 7-acetate
3.alpha.,7.beta.-Diacetyloxy-5.beta.-cholan-24-oic acid
TMS ether derivative of methyl 3.beta.,7.alpha.-dihydroxy-5.beta.-cholanoic acid
Cholan-24-oic acid, 3,7-bis[(trimethylsilyl)oxy]-, methyl ester, (3.alpha.,5.beta.,7.alpha.)-
Chenodeoxycholic acid methyl ester TMS
Methyl 3alpha,7beta-bis(trimethylsiloxy)-5beta-cholan-24-oate
Ursodeoxycholic acid, tri-TMS
Ursodeoxycholic acid tris(trimethylsilyl) ester
METHYL-3,7-DIACETYLCHENODESOXYCHOLATE
3α,7α-Dihydroxy-5β-cholan-24-oic acid, methyl ester, diacetate
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