5a-Pregnan-3b-ol-20-one
Compound with spectra: 3 NMR, 5 FTIR, 2 Raman, and 4 MS (GC)
| SpectraBase Compound ID | Hlf3Ja06mrW |
|---|---|
| InChI | InChI=1S/C21H34O2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h14-19,23H,4-12H2,1-3H3/t14-,15-,16-,17+,18-,19-,20-,21+/m0/s1 |
| InChIKey | AURFZBICLPNKBZ-FZCSVUEKSA-N |
| Mol Weight | 318.5 g/mol |
| Molecular Formula | C21H34O2 |
| Exact Mass | 318.25588 g/mol |
| Enantiomer InChIKey | AURFZBICLPNKBZ-HCKITTMESA-N |
| Copyright | Copyright © 2019-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Sample | Cayman Chemical Company |
| Source of Spectrum | Forensic Spectral Research |
| Catalog Number | 32708 |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Sample | Steraloids Inc. |
| Source of Spectrum | Forensic Spectral Research |
| Catalog Number | P3830-000 |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| 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 | P3830-000 |
| Copyright | Copyright © 2015-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Sample | Cayman Chemical Company |
| Source of Spectrum | Forensic Spectral Research |
| Catalog Number | 32708 |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Sample | J. J. Schneider, Jefferson Medical Center, Philadelphia, Pennsylvania |
| Technique | KBr WAFER |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Sample | John J. Schneider, Jefferson Medical College, Philadelphia, Pennsylvania |
| Technique | KBr WAFER |
| Copyright | Copyright © 2008-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Sample | Steraloids |
| Source of Spectrum | Forensic Spectral Research |
| Catalog Number | P3830-000 |
| Technique | KBr1 0.77mg |
| 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 | Fu-Qiang Peng, et al. Chemosphere, V.95, 2014, P.581-588 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Spectrum | E1-40-1146-7 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Spectrum | Fu-Qiang Peng, et al. Chemosphere, V.95, 2014, P.581-588 |
| 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 |
- Sepranolone
- Isopregnanolone
- 5α-Dihydro pregnenolone
- NSC 97078
- Epiallopregnanolone
- 3b-Hydroxy-5a-tetrahydroprogesteone
- 3b-Hydroxy-5a-pregnan-20-one
- 5A-PREGNAN-20-ONE, 3B-HYDROXY-,
- (3beta,5alpha)-3-hydroxypregnan-20-one
- 3-Hydroxypregnan-20-one
- 1-((3S,5S,8R,9S,10S,13S,14S,17S)-3-hydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)ethanone
3.alpha.-Fluoro-5.beta.-pregnan-20-one
Pregnan-20-one, 3-(methoxymethoxy)-, (3.beta.,5.alpha.)-
Pregn-20-en-3-ol, 20-methyl-, (3.beta.,5.alpha.)-
(8R,9S,10S,13S,14S)-17-acetyl-10,13-dimethyltetradecahydro-1H-cyclopenta[a]phenanthren-3(2H)-one
5β,17α-pregnane-3,20-dione
1-Pentanone, 1-[(5.alpha.)-androstan-17-yl]-
21-Norcholest-24-en-20-one, (5.alpha.,17.xi.)-
(23R)-23-ethylcholestan-3.beta.-ol
| Title | Journal or Book | Year |
|---|---|---|
| 13C NMR spectroscopy of some 20-ketopregnanes | Magnetic Resonance in Chemistry | 1994 |
| 13C n.m.r. spectra of steroids —a survey and commentary | Organic Magnetic Resonance | 1977 |
This compound is available in the following databases:
KnowItAll NMR Spectral Library
Author: Wiley
The KnowItAll NMR Spectral Library offers a comprehensive collection of NMR reference spectra, including NMR, CNMR, and XNMR, and covers a wide range of compounds including organics, polymers, monomers, metabolites, and more. Learn more.
KnowItAll IR, Raman, and UV-Vis Spectral Libraries
Author: Wiley
The KnowItAll IR, Raman, and UV-Vis spectral libraries offer access to the world's largest collection of IR, Raman, and UV-Vis spectra, including the renowned Sadtler spectra. The libraries include a wide range of compounds from pure organics to industrial compounds. Learn more.
KnowItAll Mass Spectral Library
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| Vendor/Supplier | Catalog Number |
|---|---|
| Cayman Chemical Company |