| SpectraBase Compound ID | HIY9AIvhGtQ |
|---|---|
| InChI | InChI=1S/C22H36O4/c1-12-9-17-16-6-5-14-10-15(24)7-8-20(14,3)19(16)18(25)11-21(17,4)22(12,26)13(2)23/h12,14-19,24-26H,5-11H2,1-4H3/t12-,14+,15+,16+,17+,18-,19-,20+,21+,22+/m1/s1 |
| InChIKey | OACVNSOUPWYEBL-JZOCASSUSA-N |
| Mol Weight | 364.5 g/mol |
| Molecular Formula | C22H36O4 |
| Exact Mass | 364.26136 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EkrvAcL6omC |
|---|---|
| Name | 3-BETA,11-ALPHA,17-ALPHA-TRIHYDROXY-16-ALPHA-METHYL-5-ALPHA-PREGNAN-20-ONE |
| Compound Number | 13 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C22H36O4 |
| InChI | InChI=1S/C22H36O4/c1-12-9-17-16-6-5-14-10-15(24)7-8-20(14,3)19(16)18(25)11-21(17,4)22(12,26)13(2)23/h12,14-19,24-26H,5-11H2,1-4H3/t12-,14+,15+,16+,17+,18-,19-,20+,21+,22+/m1/s1 |
| InChIKey | OACVNSOUPWYEBL-JZOCASSUSA-N |
| Literature Reference Author | J.A.R.GARCIA,F.A.V.NAVARRO,H.T.V.CASTRO |
| Literature Reference Citation | MAGN.RES.CHEM.,32,547(1994) |
| Literature Reference DOI | 10.1002/mrc.1260320909 |
| Molecular Weight | 364.525 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCP885 |