| SpectraBase Compound ID | ERHcWChUWNK |
|---|---|
| InChI | InChI=1S/C39H54O19/c1-11-26-28(13-33(46)56-31-12-27(18(2)14-49-20(4)40)29(19(31)3)15-50-21(5)41)30(37(47)48-10)16-52-38(26)58-39-36(55-25(9)45)35(54-24(8)44)34(53-23(7)43)32(57-39)17-51-22(6)42/h11,16,18-19,27-29,31-32,34-36,38-39H,12-15,17H2,1-10H3/b26-11-/t18?,19-,27-,28-,29+,31-,32-,34-,35+,36-,38-,39+/m0/s1 |
| InChIKey | QNGAVPJSVBSLPN-KIFXOZBDSA-N |
| Mol Weight | 826.8 g/mol |
| Molecular Formula | C39H54O19 |
| Exact Mass | 826.325929 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4iuyiEoQh1u |
|---|---|
| Name | JASUROSIDE-F-HEXA-ACETATE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C39H54O19 |
| InChI | InChI=1S/C39H54O19/c1-11-26-28(13-33(46)56-31-12-27(18(2)14-49-20(4)40)29(19(31)3)15-50-21(5)41)30(37(47)48-10)16-52-38(26)58-39-36(55-25(9)45)35(54-24(8)44)34(53-23(7)43)32(57-39)17-51-22(6)42/h11,16,18-19,27-29,31-32,34-36,38-39H,12-15,17H2,1-10H3/b26-11-/t18?,19-,27-,28-,29+,31-,32-,34-,35+,36-,38-,39+/m0/s1 |
| InChIKey | QNGAVPJSVBSLPN-KIFXOZBDSA-N |
| Literature Reference Author | Y.C.SHEN,P.W.HSIEH |
| Literature Reference Citation | PHYTOCHEM.,46,1197(1997) |
| Literature Reference DOI | 10.1016/s0031-9422(97)80011-8 |
| Molecular Weight | 826.846 g/mol |
| Sample ID | 65393 |
| Solvent | CDCl3 |