| SpectraBase Compound ID | 8hQEu2XnbKi |
|---|---|
| InChI | InChI=1S/C46H76O19/c1-19(18-59-41-37(55)34(52)32(50)28(16-47)62-41)9-12-46(58-6)20(2)31-27(65-46)15-26-24-8-7-22-13-23(14-30(49)45(22,5)25(24)10-11-44(26,31)4)61-42-39(57)36(54)40(21(3)60-42)64-43-38(56)35(53)33(51)29(17-48)63-43/h7,19-21,23-43,47-57H,8-18H2,1-6H3/t19?,20-,21-,23+,24+,25-,26-,27-,28-,29-,30+,31-,32-,33-,34+,35+,36-,37-,38-,39+,40-,41-,42-,43+,44-,45-,46?/m0/s1 |
| InChIKey | HPLXTNJKHLJJQJ-CBLULNFRSA-N |
| Mol Weight | 933.1 g/mol |
| Molecular Formula | C46H76O19 |
| Exact Mass | 932.49808 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | A9Rjbwh6ZSg |
|---|---|
| Name | HPLXTNJKHLJJQJ-CBLULNFRSA-N |
| Compound Number | 111 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C46H76O19 |
| InChI | InChI=1S/C46H76O19/c1-19(18-59-41-37(55)34(52)32(50)28(16-47)62-41)9-12-46(58-6)20(2)31-27(65-46)15-26-24-8-7-22-13-23(14-30(49)45(22,5)25(24)10-11-44(26,31)4)61-42-39(57)36(54)40(21(3)60-42)64-43-38(56)35(53)33(51)29(17-48)63-43/h7,19-21,23-43,47-57H,8-18H2,1-6H3/t19?,20-,21-,23+,24+,25-,26-,27-,28-,29-,30+,31-,32-,33-,34+,35+,36-,37-,38-,39+,40-,41-,42-,43+,44-,45-,46?/m0/s1 |
| InChIKey | HPLXTNJKHLJJQJ-CBLULNFRSA-N |
| Literature Reference Author | P.K.AGRAWAL,D.C.JAIN,A.K.PATHAK |
| Literature Reference Citation | MAGN.RES.CHEM.,33,923(1995) |
| Literature Reference DOI | 10.1002/mrc.1260331202 |
| Molecular Weight | 933.098 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWCS22199 |