| SpectraBase Compound ID | 5ScHJSY4Ezo |
|---|---|
| InChI | InChI=1S/C22H36O5/c1-20-9-6-14(23)12-13(20)4-5-15-16(20)7-10-21(2)17(15)8-11-22(21,26)18(24)19(25)27-3/h13-18,23-24,26H,4-12H2,1-3H3/t13-,14-,15-,16+,17+,18-,20+,21+,22+/m1/s1 |
| InChIKey | WKNCIKWCZRYOLS-ULEIETTHSA-N |
| Mol Weight | 380.5 g/mol |
| Molecular Formula | C22H36O5 |
| Exact Mass | 380.256274 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 63Vp3amEkQk |
|---|---|
| Name | 3α,17,20β-trihydroxy-5β-pregnan-21-oic acid, methyl ester |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C22H36O5 |
| InChI | InChI=1S/C22H36O5/c1-20-9-6-14(23)12-13(20)4-5-15-16(20)7-10-21(2)17(15)8-11-22(21,26)18(24)19(25)27-3/h13-18,23-24,26H,4-12H2,1-3H3/t13-,14-,15-,16+,17+,18-,20+,21+,22+/m1/s1 |
| InChIKey | WKNCIKWCZRYOLS-ULEIETTHSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 39934M |
| Solvent | CDCl3 |