| SpectraBase Compound ID | TwWrg78lcK |
|---|---|
| InChI | InChI=1S/C27H44O8/c1-22(2,32)9-8-20(30)25(5,33)19-7-11-26(34)16-12-21(31)27(35)14-18(29)17(28)13-24(27,4)15(16)6-10-23(19,26)3/h12,15,17-20,28-30,32-35H,6-11,13-14H2,1-5H3/t15?,17-,18+,19+,20-,23-,24-,25?,26-,27-/m1/s1 |
| InChIKey | GMFLGNRCCFYOKL-NHWNVZQOSA-N |
| Mol Weight | 496.6 g/mol |
| Molecular Formula | C27H44O8 |
| Exact Mass | 496.303618 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2B2V4WzFwMv |
|---|---|
| Name | RAPISTERONE-D;5-BETA-CHOLEST-7-EN-2-ALPHA,3-ALPHA,5,14-ALPHA,20R,22R,25-HEPTAHYDROXY-6-ONE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H44O8 |
| InChI | InChI=1S/C27H44O8/c1-22(2,32)9-8-20(30)25(5,33)19-7-11-26(34)16-12-21(31)27(35)14-18(29)17(28)13-24(27,4)15(16)6-10-23(19,26)3/h12,15,17-20,28-30,32-35H,6-11,13-14H2,1-5H3/t15?,17-,18+,19+,20-,23-,24-,25?,26-,27-/m1/s1 |
| InChIKey | GMFLGNRCCFYOKL-NHWNVZQOSA-N |
| Literature Reference Author | U.A.BALTAEV |
| Literature Reference Citation | PHYTOCHEM.,38,799(1995) |
| Literature Reference DOI | 10.1016/0031-9422(94)00592-H |
| Molecular Weight | 496.642 g/mol |
| Solvent | Unknown |
| Source File Reference | UWMS3731 |