| SpectraBase Compound ID | IdgTwWXCQ3E |
|---|---|
| InChI | InChI=1S/C30H44O4/c1-17(2)18-8-13-30(25(33)34)15-14-28(6)19(23(18)30)16-20(31)24-27(5)11-10-22(32)26(3,4)21(27)9-12-29(24,28)7/h10-11,18-21,23-24,31H,1,8-9,12-16H2,2-7H3,(H,33,34)/t18-,19?,20+,21?,23+,24?,27-,28+,29+,30-/m0/s1 |
| InChIKey | UPDJREZIQQLNRN-QYSSWEFSSA-N |
| Mol Weight | 468.7 g/mol |
| Molecular Formula | C30H44O4 |
| Exact Mass | 468.32396 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1ynISJEXP5P |
|---|---|
| Name | DEHYDROPROTOCHIISANOGENIN |
| Compound Number | 5B |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H44O4 |
| InChI | InChI=1S/C30H44O4/c1-17(2)18-8-13-30(25(33)34)15-14-28(6)19(23(18)30)16-20(31)24-27(5)11-10-22(32)26(3,4)21(27)9-12-29(24,28)7/h10-11,18-21,23-24,31H,1,8-9,12-16H2,2-7H3,(H,33,34)/t18-,19?,20+,21?,23+,24?,27-,28+,29+,30-/m0/s1 |
| InChIKey | UPDJREZIQQLNRN-QYSSWEFSSA-N |
| Literature Reference Author | K.SHIRASUNA,M.MIYAKOSHI,S.MIMOTO,S.ISODA,Y.SATOH,Y.HIRAI,Y.I DA,J.SHOJI |
| Literature Reference Citation | PHYTOCHEM.,45,579(1997) |
| Literature Reference DOI | 10.1016/S0031-9422(97)00017-4 |
| Molecular Weight | 468.677 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWSP1468 |