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3Alpha-hydroxy-5beta-chol-6-en-24-oic acid, methyl ester, acetate

Compound with spectra: 3 NMR, and 1 FTIR

3Alpha-hydroxy-5beta-chol-6-en-24-oic acid, methyl ester, acetate
SpectraBase Compound ID 66EzpkG4sco
InChI InChI=1S/C27H42O4/c1-17(6-11-25(29)30-5)22-9-10-23-21-8-7-19-16-20(31-18(2)28)12-14-26(19,3)24(21)13-15-27(22,23)4/h7-8,17,19-24H,6,9-16H2,1-5H3/t17-,19-,20-,21+,22-,23+,24+,26+,27-/m1/s1
InChIKey ZUXCJTMUJNGXDG-VCRDOGAPSA-N
Mol Weight 430.6 g/mol
Molecular Formula C27H42O4
Exact Mass 430.30831 g/mol
Enantiomer InChIKey ZUXCJTMUJNGXDG-ACCPVXDNSA-N

View Spectrum of 3Alpha-hydroxy-5beta-chol-6-en-24-oic acid, methyl ester, acetate

13C NMR Spectrum
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.

View Spectrum of 3Alpha-hydroxy-5beta-chol-6-en-24-oic acid, methyl ester, acetate

1H NMR Spectrum
Copyright Copyright © 1991-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Solvent CDCl3; Reference=TMS; Temperature 297K

View Spectrum of 3Alpha-hydroxy-5beta-chol-6-en-24-oic acid, methyl ester, acetate

1H NMR Spectrum
Copyright Copyright © 2009-2025 John Wiley & Sons, Inc. All Rights Reserved.
Solvent CDCl3

View Spectrum of 3Alpha-hydroxy-5beta-chol-6-en-24-oic acid, methyl ester, acetate

FTIR Spectrum
Copyright Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Catalog Number S63725
Technique KBr WAFER
  • 5B-CHOL-6-EN-24-OIC ACID, 3A-HYDROXY-, METHYL ESTER, ACETATE
21.xi-Methyl-17-isocholest-5-en-3.beta.,16.xi-diol
24-Methyl-3-oxo-5.beta.-chol-1,6-dienoate
UDCA-[G#1]-COOH
N-[4N-methylpiperazin-1-yl)-3.alpha.,7.beta.-di-acetoxy-5-.beta.cholan-24-amide
No Name
Methyl 3-oxochola-4,6-dien-24-oate
METHYL-3,7-DIACETYLCHENODESOXYCHOLATE
Cholan-24-oic acid, 3,7-bis(acetyloxy)-, methyl ester, (3.alpha.,7.alpha.)-
9a,11a-dimethyl-1-(1,5-dimethylhexyl)-2,3,3a,3b,9,9a,9b,10,11,11a-decahydro-1H-cyclopenta[f]pyrrolo[2,1-a]isoquinolin-7(8H)-one
Chol-5-en-24-oic acid, 3-[(trifluoroacetyl)oxy]-, methyl ester, (3.beta.)-
Other Resources
Unknown Identification

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