| SpectraBase Compound ID | LUMgm6LvT4I |
|---|---|
| InChI | InChI=1S/C36H48O19/c1-16-26(42)28(44)30(46)35(51-16)54-32-31(53-25(41)9-6-17-4-7-19(38)23(13-17)48-3)24(14-37)52-36(33(32)55-34-29(45)27(43)21(40)15-50-34)49-11-10-18-5-8-22(47-2)20(39)12-18/h4-9,12-13,16,21,24,26-40,42-46H,10-11,14-15H2,1-3H3/b9-6+/t16-,21-,24+,26-,27-,28+,29+,30+,31+,32-,33+,34?,35?,36+/m0/s1 |
| InChIKey | NPSOGVDABORBNJ-LOKNIUPKSA-N |
| Mol Weight | 784.8 g/mol |
| Molecular Formula | C36H48O19 |
| Exact Mass | 784.278979 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8BRJ4TiedP4 |
|---|---|
| Name | LAGOTOSIDE |
| Compound Number | 8 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H48O19 |
| InChI | InChI=1S/C36H48O19/c1-16-26(42)28(44)30(46)35(51-16)54-32-31(53-25(41)9-6-17-4-7-19(38)23(13-17)48-3)24(14-37)52-36(33(32)55-34-29(45)27(43)21(40)15-50-34)49-11-10-18-5-8-22(47-2)20(39)12-18/h4-9,12-13,16,21,24,26-40,42-46H,10-11,14-15H2,1-3H3/b9-6+/t16-,21-,24+,26-,27-,28+,29+,30+,31+,32-,33+,34?,35?,36+/m0/s1 |
| InChIKey | NPSOGVDABORBNJ-LOKNIUPKSA-N |
| Literature Reference Author | I.CAHS,D.TASDEMIR,A.D.WRIGHT,O.STICHER |
| Literature Reference Citation | HELV.CHIM.ACTA,74,1273(1991) |
| Literature Reference DOI | 10.1002/hlca.19910740615 |
| Molecular Weight | 784.766 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWVP5749 |