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3a,6a-Dihydroxy-5ß-cholan-24-oic acid

Compound with spectra: 3 NMR, 5 FTIR, 1 Raman, and 1 MS (GC)

3a,6a-Dihydroxy-5ß-cholan-24-oic acid
SpectraBase Compound ID 8pOu1Xmubdc
InChI InChI=1S/C24H40O4/c1-14(4-7-22(27)28)17-5-6-18-16-13-21(26)20-12-15(25)8-10-24(20,3)19(16)9-11-23(17,18)2/h14-21,25-26H,4-13H2,1-3H3,(H,27,28)/t14-,15-,16+,17-,18+,19+,20+,21+,23-,24-/m1/s1
InChIKey DGABKXLVXPYZII-SIBKNCMHSA-N
Mol Weight 392.6 g/mol
Molecular Formula C24H40O4
Exact Mass 392.29266 g/mol
Enantiomer InChIKey DGABKXLVXPYZII-BTNODCHPSA-N

View Spectrum of 3a,6a-Dihydroxy-5ß-cholan-24-oic acid

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

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1H NMR Spectrum
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Sigma-Aldrich Co. LLC.
Source of Spectrum Sigma-Aldrich Co. LLC.
Catalog Number 260134
Solvent CDCl3 & DMSO-d6

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Raman Spectrum
Copyright Copyright © 2015-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample TCI Chemicals India Pvt. Ltd.
Source of Spectrum Bio-Rad Laboratories, Inc.
Catalog Number H0535

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FTIR Spectrum
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample E. MERCK AG, DARMSTADT, GERMANY
Technique KBr WAFER

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FTIR Spectrum
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Jefferson Medical College, Philadelphia, Pennsylvania
Technique KBr WAFER

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FTIR Spectrum
Copyright Copyright © 2015-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample TCI Chemicals India Pvt. Ltd.
Source of Spectrum Bio-Rad Laboratories, Inc.
Catalog Number H0535
Technique KBr1

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ATR-IR Spectrum
Copyright Copyright © 2015-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample TCI Chemicals India Pvt. Ltd.
Source of Spectrum Bio-Rad Laboratories, Inc.
Catalog Number H0535

View Spectrum of 3a,6a-Dihydroxy-5ß-cholan-24-oic acid

ATR-IR Spectrum
Copyright Copyright © 2018-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Aldrich
Catalog Number 260134

View Spectrum of 3a,6a-Dihydroxy-5ß-cholan-24-oic acid

MS (GC) Spectrum
Copyright Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved.
Source of Spectrum Prof. D. Henneberg, MPI f. Kohlenforschung, Muelheim a.d.R., Germany

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13C NMR Spectrum
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Sigma-Aldrich Co. LLC.
Source of Spectrum Sigma-Aldrich Co. LLC.
Catalog Number 260134
Solvent CDCl3 & DMSO-d6
  • Hyodeoxycholic acid
  • CHOLANIC ACID, 3A,6A-DIHYDROXY-,
  • CHOLAN-24-OIC ACID, 3,6-DIHYDROXY-, (3alpha,5beta,6alpha)-
  • (4R)-4-[(1S,2R,5R,7R,8S,10S,11S,14R,15R)-5,8-dihydroxy-2,15-dimethyltetracyclo[8.7.0.0(2,7).0(11,15)]heptadecan-14-yl]pentanoic acid
  • 3,6-DIHYDROXYCHOLAN-24-OIC ACID
CHOLAN-24-OIC ACID, 3,6-DIHYDROXY-, (3alpha,5beta,6alpha)-
METHYL-HYODESOXYCHOLATE
5-BETA-CHOLESTAN-3-ALPHA,6-ALPHA-DIOL
5-BETA-CHOLESTAN-3-BETA,6-BETA-DIOL
5-BETA-CHOLESTAN-3-BETA,6-ALPHA-DIOL
5-BETA-CHOLESTAN-3-ALPHA,6-BETA-DIOL
5-ALPHA-STIGMAST-3-BETA,6-ALPHA-DIOL
(24S)-24-ETHYL-5-ALPHA-CHOLESTANE-3-BETA,6-BETA-DIOL
(3S,5R,6S,8S,9S,10R,13R,14S,17R)-17-[(1R)-1,5-dimethylhexyl]-3-methoxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-6-ol
(3S,5S,6S,8S,9S,10R,13R,14S,17R)-17-[(1R)-1,5-dimethylhexyl]-3-methoxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-6-ol
24-Nor-5β-chol-22-ene-3α,6α-diol
CHOLAN-24-OIC ACID, 3-HYDROXY-, (3alpha,5beta)-
CHOLAN-24-OIC ACID, 3,6-DIHYDROXY-, (3alpha,5beta,6alpha)-
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