| SpectraBase Compound ID | 2TFctIhhktx |
|---|---|
| InChI | InChI=1S/C25H40O6/c1-17(2)9-7-10-19(5)11-8-12-20(6)13-14-29-25-23(28)24(21(26)16-30-25)31-22(27)15-18(3)4/h9,11,13,15,21,23-26,28H,7-8,10,12,14,16H2,1-6H3/b19-11+,20-13+/t21-,23-,24+,25-/m1/s1 |
| InChIKey | UGQQSVKXYJBPSA-KTNXQVLPSA-N |
| Mol Weight | 436.6 g/mol |
| Molecular Formula | C25H40O6 |
| Exact Mass | 436.282489 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DnU0K0kY0Zq |
|---|---|
| Name | PANCHERIN-B;1'-O-FARNESYL-3'-SENECIOYL-BETA-D-XYLOPYRANOSIDE |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C25H40O6 |
| InChI | InChI=1S/C25H40O6/c1-17(2)9-7-10-19(5)11-8-12-20(6)13-14-29-25-23(28)24(21(26)16-30-25)31-22(27)15-18(3)4/h9,11,13,15,21,23-26,28H,7-8,10,12,14,16H2,1-6H3/b19-11+,20-13+/t21-,23-,24+,25-/m1/s1 |
| InChIKey | UGQQSVKXYJBPSA-KTNXQVLPSA-N |
| Literature Reference Author | V.EPARVIER,O.THOISON,H.BOUSSEROUEL,F.GUERITTE,T.SEVENET,M.LI TAUDON |
| Literature Reference Citation | PHYTOCHEM.,68,604(2007) |
| Literature Reference DOI | 10.1016/j.phytochem.2006.11.008 |
| Molecular Weight | 436.589 g/mol |
| Sample ID | 62465 |
| Solvent | CDCl3 |