| SpectraBase Compound ID | 5NInygg6aZq |
|---|---|
| InChI | InChI=1S/C21H34O4/c1-13(22)16-7-9-20(24)17-5-4-14-12-15(23)6-8-18(14,2)21(17,25)11-10-19(16,20)3/h14-17,23-25H,4-12H2,1-3H3/t14-,15+,16-,17+,18+,19-,20-,21-/m1/s1 |
| InChIKey | LXIKZPWPXBWPOP-SHFIKRAWSA-N |
| Mol Weight | 350.5 g/mol |
| Molecular Formula | C21H34O4 |
| Exact Mass | 350.24571 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1WM4k4nwtN4 |
|---|---|
| Name | 3-BETA,9-ALPHA,14-ALPHA-TRIHYDROXY-5-BETA-PREGNANE-20-ONE |
| Compound Number | 3B |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H34O4 |
| InChI | InChI=1S/C21H34O4/c1-13(22)16-7-9-20(24)17-5-4-14-12-15(23)6-8-18(14,2)21(17,25)11-10-19(16,20)3/h14-17,23-25H,4-12H2,1-3H3/t14-,15+,16-,17+,18+,19-,20-,21-/m1/s1 |
| InChIKey | LXIKZPWPXBWPOP-SHFIKRAWSA-N |
| Literature Reference Author | S.H.HU,G.GENAIN,R.AZERAD |
| Literature Reference Citation | STEROIDS,60,337(1995) |
| Literature Reference DOI | 10.1016/0039-128x(95)00006-c |
| Molecular Weight | 350.499 g/mol |
| Sample ID | 968613 |
| Solvent | CD3OD |