| SpectraBase Compound ID | 6SkmOtdXd2H |
|---|---|
| InChI | InChI=1S/C35H52O14/c1-17-30(49-31-29(42)28(41)27(40)24(14-36)48-31)23(38)12-26(46-17)47-19-3-8-33(16-37)21-4-7-32(2)20(18-11-25(39)45-15-18)6-10-35(32,44)22(21)5-9-34(33,43)13-19/h11,16-17,19-24,26-31,36,38,40-44H,3-10,12-15H2,1-2H3/t17-,19-,20+,21?,22?,23+,24-,26+,27-,28+,29-,30-,31+,32+,33-,34-,35-/m0/s1 |
| InChIKey | KQBVSIZPUWODNU-SUERLPTRSA-N |
| Mol Weight | 696.8 g/mol |
| Molecular Formula | C35H52O14 |
| Exact Mass | 696.335706 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AR4ricdDRLq |
|---|---|
| Name | ERYSIMOSIDE;STROPHANTHIDIN-3-O-BETA-D-GLUCOPYRANOSYL-(1->4)-O-BETA-D-DIGITOXOPYRANOSIDE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C35H52O14 |
| InChI | InChI=1S/C35H52O14/c1-17-30(49-31-29(42)28(41)27(40)24(14-36)48-31)23(38)12-26(46-17)47-19-3-8-33(16-37)21-4-7-32(2)20(18-11-25(39)45-15-18)6-10-35(32,44)22(21)5-9-34(33,43)13-19/h11,16-17,19-24,26-31,36,38,40-44H,3-10,12-15H2,1-2H3/t17-,19-,20+,21?,22?,23+,24-,26+,27-,28+,29-,30-,31+,32+,33-,34-,35-/m0/s1 |
| InChIKey | KQBVSIZPUWODNU-SUERLPTRSA-N |
| Literature Reference Author | T.NAKAMURA,Y.GODA,S.SAKAI,K.KONDO,H.AKIYAMA,M.TOYODA |
| Literature Reference Citation | PHYTOCHEM.,49,2097(1998) |
| Literature Reference DOI | 10.1016/S0031-9422(98)00421-X |
| Molecular Weight | 696.789 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWLU884 |