| SpectraBase Compound ID | 8Mmksuu9LWG |
|---|---|
| InChI | InChI=1S/C21H31NO9/c1-5-20(27)12(4)30-17(24)16(23)21(28,11(2)3)19(26)31-14-7-9-22-8-6-13(15(14)22)10-29-18(20)25/h6,11-12,14-16,23,27-28H,5,7-10H2,1-4H3/t12-,14-,15-,16+,20+,21-/m1/s1 |
| InChIKey | SAPQZIXQNLIRLW-SXWITCMUSA-N |
| Mol Weight | 441.48 g/mol |
| Molecular Formula | C21H31NO9 |
| Exact Mass | 441.199882 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DUjGjh9A6TF |
|---|---|
| Name | PARSONSIANINE |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H31NO9 |
| InChI | InChI=1S/C21H31NO9/c1-5-20(27)12(4)30-17(24)16(23)21(28,11(2)3)19(26)31-14-7-9-22-8-6-13(15(14)22)10-29-18(20)25/h6,11-12,14-16,23,27-28H,5,7-10H2,1-4H3/t12-,14-,15-,16+,20+,21-/m1/s1 |
| InChIKey | SAPQZIXQNLIRLW-SXWITCMUSA-N |
| Literature Reference Author | F.ABE,T.NAGAO,H.OKABE,T.YAMAUCHI |
| Literature Reference Citation | PHYTOCHEM.,30,1737(1991) |
| Literature Reference DOI | 10.1016/0031-9422(91)84253-O |
| Molecular Weight | 441.478 g/mol |
| Solvent | CDCl3:CD3OD |
| Source File Reference | UWLU27557 |