| SpectraBase Compound ID | 3f3hojlCSWb |
|---|---|
| InChI | InChI=1S/C25H32O9/c1-14-6-5-7-15(2)11-21(22-17(4)24(30)33-20(22)10-14)34-25(31)18(8-9-26)13-32-23(29)16(3)19(28)12-27/h7-8,10,19-22,26-28H,3-6,9,11-13H2,1-2H3/b14-10+,15-7+,18-8+/t19?,20-,21+,22+/m1/s1 |
| InChIKey | YOGPJYWETDSFNM-MDLPYSPHSA-N |
| Mol Weight | 476.5 g/mol |
| Molecular Formula | C25H32O9 |
| Exact Mass | 476.204633 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LDIbB4qQLYK |
|---|---|
| Name | CAUDATOL;COMFORMER_2 |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C25H32O9 |
| InChI | InChI=1S/C25H32O9/c1-14-6-5-7-15(2)11-21(22-17(4)24(30)33-20(22)10-14)34-25(31)18(8-9-26)13-32-23(29)16(3)19(28)12-27/h7-8,10,19-22,26-28H,3-6,9,11-13H2,1-2H3/b14-10+,15-7+,18-8+/t19?,20-,21+,22+/m1/s1 |
| InChIKey | YOGPJYWETDSFNM-MDLPYSPHSA-N |
| Literature Reference Author | S.D.JOLAD,J.J.HOFFMANN,R.D.BATES,S.CALDERS,S.P.MCLAUGHLIN |
| Literature Reference Citation | PHYTOCHEM.,29,3024(1990) |
| Literature Reference DOI | 10.1016/0031-9422(90)87128-H |
| Molecular Weight | 476.524 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMZ17692 |