| SpectraBase Compound ID | IJx893TyvkJ |
|---|---|
| InChI | InChI=1S/C22H34O3/c1-13(12-23)17-6-7-18-16-5-4-14-10-15(24)8-9-21(14,2)19(16)11-20(25)22(17,18)3/h10,13,16-20,23,25H,4-9,11-12H2,1-3H3/t13-,16+,17-,18+,19+,20+,21+,22-/m1/s1 |
| InChIKey | JHPSULFQCASESS-LJGMHQGMSA-N |
| Mol Weight | 346.5 g/mol |
| Molecular Formula | C22H34O3 |
| Exact Mass | 346.250795 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AnIjG761m6X |
|---|---|
| Name | (20)S-HYDROXYMETHYL-12-ALPHA-HYDROXYPREGN-4-EN-3-ONE |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C22H34O3 |
| InChI | InChI=1S/C22H34O3/c1-13(12-23)17-6-7-18-16-5-4-14-10-15(24)8-9-21(14,2)19(16)11-20(25)22(17,18)3/h10,13,16-20,23,25H,4-9,11-12H2,1-3H3/t13-,16+,17-,18+,19+,20+,21+,22-/m1/s1 |
| InChIKey | JHPSULFQCASESS-LJGMHQGMSA-N |
| Literature Reference Author | K.C.WANG,B.J.YOU,J.L.YAN,S.S.LEE |
| Literature Reference Citation | J.NAT.PROD.,58,1222(1995) |
| Literature Reference DOI | 10.1021/np50122a010 |
| Molecular Weight | 346.510 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWPR1011 |