| SpectraBase Compound ID | CxP2FIbOp5W |
|---|---|
| InChI | InChI=1S/C41H50O21/c1-38-15-40(51)23-11-41(38,39(23,37(61-38)62-40)16-55-32(50)17-7-3-2-4-8-17)60-36-30(49)27(46)31-22(58-36)14-53-33(59-31)18-9-5-6-10-20(18)56-35-29(48)26(45)25(44)21(57-35)13-54-34-28(47)24(43)19(42)12-52-34/h2-10,19,21-31,33-37,42-49,51H,11-16H2,1H3/t19-,21+,22-,23+,24-,25+,26-,27-,28+,29+,30-,31-,33-,34-,35+,36+,37+,38-,39-,40+,41-/m0/s1 |
| InChIKey | HURNHSBFEAXLIM-LMBSVAERSA-N |
| Mol Weight | 878.8 g/mol |
| Molecular Formula | C41H50O21 |
| Exact Mass | 878.284459 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6hRnAwFsPvR |
|---|---|
| Name | PAEONIHYBRIDIN |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C41H50O21 |
| InChI | InChI=1S/C41H50O21/c1-38-15-40(51)23-11-41(38,39(23,37(61-38)62-40)16-55-32(50)17-7-3-2-4-8-17)60-36-30(49)27(46)31-22(58-36)14-53-33(59-31)18-9-5-6-10-20(18)56-35-29(48)26(45)25(44)21(57-35)13-54-34-28(47)24(43)19(42)12-52-34/h2-10,19,21-31,33-37,42-49,51H,11-16H2,1H3/t19-,21+,22-,23+,24-,25+,26-,27-,28+,29+,30-,31-,33-,34-,35+,36+,37+,38-,39-,40+,41-/m0/s1 |
| InChIKey | HURNHSBFEAXLIM-LMBSVAERSA-N |
| Literature Reference Author | M.OKASAKA,Y.KASHIWADA,O.K.KODZHIMATOV,O.ASHURMETOV,Y.TAKAISH I |
| Literature Reference Citation | PHYTOCHEM.,69,1767(2008) |
| Literature Reference DOI | 10.1016/j.phytochem.2008.02.016 |
| Molecular Weight | 878.835 g/mol |
| Sample ID | 44149 |
| Solvent | CD3OD |