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3α,7α-dihydroxy-5β-cholan-24-oic acid, methyl ester, 7-acetate

Compound with spectra: 2 NMR, and 1 FTIR

3α,7α-dihydroxy-5β-cholan-24-oic acid, methyl ester, 7-acetate
SpectraBase Compound ID ISSrWtfTs38
InChI InChI=1S/C27H44O5/c1-16(6-9-24(30)31-5)20-7-8-21-25-22(11-13-27(20,21)4)26(3)12-10-19(29)14-18(26)15-23(25)32-17(2)28/h16,18-23,25,29H,6-15H2,1-5H3/t16-,18+,19-,20-,21+,22+,23-,25+,26+,27-/m1/s1
InChIKey PMJBQFRZSVOFFB-OSFGXRAKSA-N
Mol Weight 448.6 g/mol
Molecular Formula C27H44O5
Exact Mass 448.318875 g/mol
Enantiomer InChIKey PMJBQFRZSVOFFB-BSRCQGDWSA-N

View Spectrum of 3α,7α-dihydroxy-5β-cholan-24-oic acid, methyl ester, 7-acetate

13C NMR Spectrum
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20

View Spectrum of 3α,7α-dihydroxy-5β-cholan-24-oic acid, methyl ester, 7-acetate

1H NMR Spectrum
Copyright Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved.
Solvent CDCl3

View Spectrum of 3α,7α-dihydroxy-5β-cholan-24-oic acid, methyl ester, 7-acetate

FTIR Spectrum
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Catalog Number S35259
Technique KBr WAFER
  • CHENODEOXYCHOLIC ACID, METHYL ESTER, 7-ACETATE
  • 5B-CHOLAN-24-OIC ACID, 3A,7A-DIHYDROXY-, METHYL ESTER, 7-ACETATE
Cholan-24-oic acid, 3,7-bis(acetyloxy)-, methyl ester, (3.alpha.,7.alpha.)-
METHYL-3,7-DIACETYLCHENODESOXYCHOLATE
3.alpha.,7.beta.-diacetyloxy-5.beta.-cholan-24-oic acid
UDCA-[G#1]-COOH
Methyl 3-hydroxy-7-methoxycholan-24-oate
3.alpha.,7.alpha.,24-tris(Acetoxy)-5.beta.-cholane
Cholestan-26-oic acid, 3,7-bis(acetyloxy)-, methyl ester, (3.alpha.,5.beta.,7.alpha.)-
(3.alpha.,5.beta.,7.alpha.)-3,7-Bis(acetyloxy)-24-norcholan-23-oic acid
7a-Acetoxy-5b-cholanic acid, methyl ester
7-ALPHA-ACETOXY-5-BETA-CHOLSAEUREMETHYLESTER
Other Resources
Unknown Identification

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