| SpectraBase Compound ID | 5RxwIE8jfg8 |
|---|---|
| InChI | InChI=1S/C30H52O2/c1-25(2)15-9-16-27(5)22(25)13-18-29(7)23(27)11-10-20-21(12-17-28(20,29)6)30(8)19-14-24(32-30)26(3,4)31/h20-24,31H,9-19H2,1-8H3/t20-,21+,22?,23?,24+,27+,28-,29-,30-/m1/s1 |
| InChIKey | QSEHIGFXDFOYFB-QHAHNMDHSA-N |
| Mol Weight | 444.7 g/mol |
| Molecular Formula | C30H52O2 |
| Exact Mass | 444.396731 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DkQ7Fpku1uD |
|---|---|
| Name | 3-DEOXYOCOTILLOL |
| Compound Number | 8 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H52O2 |
| InChI | InChI=1S/C30H52O2/c1-25(2)15-9-16-27(5)22(25)13-18-29(7)23(27)11-10-20-21(12-17-28(20,29)6)30(8)19-14-24(32-30)26(3,4)31/h20-24,31H,9-19H2,1-8H3/t20-,21+,22?,23?,24+,27+,28-,29-,30-/m1/s1 |
| InChIKey | QSEHIGFXDFOYFB-QHAHNMDHSA-N |
| Literature Reference Author | H.YAMASHITA,K.MASUDA,T.KOBAYASHI,H.AGETA,K.SHIOJIMA |
| Literature Reference Citation | PHYTOCHEM.,49,2461(1998) |
| Literature Reference DOI | 10.1016/S0031-9422(98)00303-3 |
| Molecular Weight | 444.742 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU1081 |