| SpectraBase Compound ID | F5zIbwFaleH |
|---|---|
| InChI | InChI=1S/C30H46O10/c1-14-24(34)26(37-4)25(35)27(39-14)40-17-7-8-28(2)16(10-17)5-6-18-19(28)11-21(32)29(3)23(15-9-22(33)38-13-15)20(31)12-30(18,29)36/h9,14,16-21,23-27,31-32,34-36H,5-8,10-13H2,1-4H3/t14-,16?,17?,18?,19?,20?,21?,23?,24+,25-,26-,27-,28?,29?,30?/m1/s1 |
| InChIKey | FAAUXNJCOFXHBZ-RVUWLQMBSA-N |
| Mol Weight | 566.7 g/mol |
| Molecular Formula | C30H46O10 |
| Exact Mass | 566.309098 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FJNEwH9gpLl |
|---|---|
| Name | Diginatigenin 3-O-B-digitaloside |
| Comments | CD3OD/CDCL3 |
| Copyright | Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C30H46O10 |
| InChI | InChI=1S/C30H46O10/c1-14-24(34)26(37-4)25(35)27(39-14)40-17-7-8-28(2)16(10-17)5-6-18-19(28)11-21(32)29(3)23(15-9-22(33)38-13-15)20(31)12-30(18,29)36/h9,14,16-21,23-27,31-32,34-36H,5-8,10-13H2,1-4H3/t14-,16?,17?,18?,19?,20?,21?,23?,24+,25-,26-,27-,28?,29?,30?/m1/s1 |
| InChIKey | FAAUXNJCOFXHBZ-RVUWLQMBSA-N |
| Instrument Name | Bruker WH-400 |
| Literature Reference | D. Krueger, M. Wichtl, Planta Medica 50, 168 (1984). |
| NMR Standard | not reported |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | Mixture |