5alpha-CHOLESTANE
Compound with spectra: 11 NMR, 5 FTIR, 2 Raman, and 3 MS (GC)
| SpectraBase Compound ID | HNdvOskgxYc |
|---|---|
| InChI | InChI=1S/C27H48/c1-19(2)9-8-10-20(3)23-14-15-24-22-13-12-21-11-6-7-17-26(21,4)25(22)16-18-27(23,24)5/h19-25H,6-18H2,1-5H3/t20-,21-,22+,23-,24+,25+,26+,27-/m1/s1 |
| InChIKey | XIIAYQZJNBULGD-XWLABEFZSA-N |
| Mol Weight | 372.7 g/mol |
| Molecular Formula | C27H48 |
| Exact Mass | 372.375602 g/mol |
| Enantiomer InChIKey | XIIAYQZJNBULGD-OARHIOPISA-N |
| Copyright | Copyright © 2012-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Sample | Steraloids Inc. |
| Source of Spectrum | Forensic Spectral Research |
| Catalog Number | C3300-000 |
| Technique | KBr0P |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Sample | Fluka Chemie AG, Buchs, Switzerland |
| Catalog Number | 26700 |
| Technique | KBr WAFER |
| Copyright | Copyright © 2018-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Sample | Aldrich |
| Source of Spectrum | Sigma-Aldrich Co. LLC. |
| Catalog Number | 150320 |
| Technique | Mull |
| Copyright | Copyright © 2014-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Sample | Steraloids Inc. |
| Source of Spectrum | Forensic Spectral Research |
| Catalog Number | C3300-000 |
| 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 | 150320 |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Solvent | Chloroform-d |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | CDCl3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | CDCl3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | CDCl3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | CH2Cl2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | CDCl3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | CDCl3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | CDCl3 |
| 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 | 150320 |
| Solvent | CDCl3 |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Solvent | CDCl3 |
| 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 | 150320 |
| Solvent | CDCl3 |
| Copyright | Copyright © 2013-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Sample | Steraloids Inc. |
| Source of Spectrum | Forensic Spectral Research |
| Catalog Number | C3300-000 |
| Copyright | Copyright © 2017-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2017-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Catalog Number | 150320 |
| Copyright | Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
|---|
| Copyright | Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
|---|---|
| Source of Spectrum | Prof. Spiteller, University Bayreuth, Germany |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Spectrum | WX-1981-6-0 |
- α-Cholestane
- 28,29,30-Trinorlanostane
- 10,13-Dimethyl-17-(1',5'-dimethylhexyl)hexadecahydrocyclopenta(a)phenanthrene
- Cholestane
- 5-alpha-CHOLESTAN
- (5R,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-17-((R)-6-methylheptan-2-yl)hexadecahydro-1H-cyclopenta[a]phenanthrene
- (1S,2S,7R,10R,11S,14R,15R)-2,15-dimethyl-14-[(2R)-6-methylheptan-2-yl]tetracyclo[8.7.0.0(2,7).0(11,15)]heptadecane
- CHOLESTANE, (5.ALPHA.)-
5-Alpha,14-beta-D-17-beta-cholestane
14-.beta.(D)-17-.beta.(H)-cholestane
5alpha-CHOLESTANE
5alpha-CHOLESTANE
(20S)-5alpha,14beta,17beta(H)-CHOLESTANE
5alpha-CHOLESTANE
2,2,4,4,5,7,7-D7-CHOLESTANE
5-alpha-CHOLESTAN
Cholestane-2,3-D2
5alpha-CHOLESTANE
COPROSTANE
5alpha-CHOLESTANE
Cholestane
2,2,4,4-D4-CHOLESTANE
Cholestane
| Title | Journal or Book | Year |
|---|---|---|
| Carbon-13 nuclear magnetic resonance spectra of monounsaturated steroids. Evaluation of rules for predicting their chemical shifts | The Journal of Organic Chemistry | 1981 |
| Assignment of the 13C N.M.R. Spectra of Some 22,26-Epiminocholestanes 22,26-Epiminocholest-22(N)-enes and Some 3β-Amino Steroidal Alkaloids | Australian Journal of Chemistry | 1979 |
| Additivity relations in carbon-13 nuclear magnetic resonance spectra of dihydroxy steroids | The Journal of Organic Chemistry | 1977 |
| 13C n.m.r. spectra of steroids —a survey and commentary | Organic Magnetic Resonance | 1977 |
| Carbon-13 nuclear magnetic resonance spectra of hydroxy steroids | The Journal of Organic Chemistry | 1976 |
| Nuclear magnetic resonance spectroscopy. Carbon-13 spectra of cholic acids and hydrocarbons included in sodium desoxycholate solutions | Journal of the American Chemical Society | 1973 |
| 10.1002/(sici)1097-458x(199610)34:10<840::aid-omr1908>3.3.co;2-b | "" | "" |
This compound is available in the following databases:
Mass Spectra of Geochemicals, Petrochemicals and Biomarkers
Author: J. W. De Leeuw
Mass Spectra of Geochemicals, Petrochemicals and Biomarkers is a high-quality database for organic, geo, and/or petrochemist featuring mass spectra of well-defined compounds. Learn more.