| SpectraBase Compound ID | DkbXtWbqzun |
|---|---|
| InChI | InChI=1S/C33H52O6/c1-19(2)10-11-27-32(9,39-29(5,6)38-27)26-13-15-33(35)21-16-23(34)22-17-24-25(37-28(3,4)36-24)18-30(22,7)20(21)12-14-31(26,33)8/h16,19-20,22,24-27,35H,10-15,17-18H2,1-9H3/t20-,22-,24+,25-,26-,27+,30+,31+,32+,33+/m0/s1 |
| InChIKey | HZCJWXDACPALQX-IKLZMEIBSA-N |
| Mol Weight | 544.8 g/mol |
| Molecular Formula | C33H52O6 |
| Exact Mass | 544.376389 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AiRueXOBlrO |
|---|---|
| Name | 2,3:20,22-DIACETONIDE-PONASTERONE-A;(20R,22R)-14-ALPHA-HYDROXY-2-BETA,3-BETA:20,22-BIS-O-ISOPROPYLIDENE-5-BETA-CHOLEST-7-EN-6-ONE |
| Compound Number | IX |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C33H52O6 |
| InChI | InChI=1S/C33H52O6/c1-19(2)10-11-27-32(9,39-29(5,6)38-27)26-13-15-33(35)21-16-23(34)22-17-24-25(37-28(3,4)36-24)18-30(22,7)20(21)12-14-31(26,33)8/h16,19-20,22,24-27,35H,10-15,17-18H2,1-9H3/t20-,22-,24+,25-,26-,27+,30+,31+,32+,33+/m0/s1 |
| InChIKey | HZCJWXDACPALQX-IKLZMEIBSA-N |
| Literature Reference Author | V.N.ODINOKOV,R.G.SAVCHENKO,S.R.NAZMEEVA,I.V.GALYAUTDINOV,L.M .KHALILOV |
| Literature Reference Citation | RUSS.J.ORG.CHEM.,38,525(2002) |
| Literature Reference DOI | 10.1023/A:1016547122573 |
| Molecular Weight | 544.772 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMZ9856 |