| SpectraBase Compound ID | GjWPc9Ai47f |
|---|---|
| InChI | InChI=1S/C41H64O14/c1-19-36(47)28(42)15-34(50-19)54-38-21(3)52-35(17-30(38)44)55-37-20(2)51-33(16-29(37)43)53-24-8-10-39(4)23(13-24)6-7-26-27(39)14-31(45)40(5)25(9-11-41(26,40)48)22-12-32(46)49-18-22/h12,19-21,23-31,33-38,42-45,47-48H,6-11,13-18H2,1-5H3/t19-,20+,21-,23?,24?,25?,26?,27?,28+,29-,30+,31?,33-,34+,35+,36-,37+,38-,39?,40?,41?/m0/s1 |
| InChIKey | LTMHDMANZUZIPE-LZDJZHBQSA-N |
| Mol Weight | 780.9 g/mol |
| Molecular Formula | C41H64O14 |
| Exact Mass | 780.429607 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | L1euaKYmRqs |
|---|---|
| Name | Digoxin |
| CAS Registry Number | 20830-75-5 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C41H64O14 |
| InChI | InChI=1S/C41H64O14/c1-19-36(47)28(42)15-34(50-19)54-38-21(3)52-35(17-30(38)44)55-37-20(2)51-33(16-29(37)43)53-24-8-10-39(4)23(13-24)6-7-26-27(39)14-31(45)40(5)25(9-11-41(26,40)48)22-12-32(46)49-18-22/h12,19-21,23-31,33-38,42-45,47-48H,6-11,13-18H2,1-5H3/t19-,20+,21-,23?,24?,25?,26?,27?,28+,29-,30+,31?,33-,34+,35+,36-,37+,38-,39?,40?,41?/m0/s1 |
| InChIKey | LTMHDMANZUZIPE-LZDJZHBQSA-N |
| Instrument Name | Varian CFT-20 |
| Literature Reference | L. Brown, H.T. Cheung, R. Thomas, J. Chem. Soc. Perkin I 1779 (1981). |
| NMR Standard | CDCl3 |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3/DMSO-D6 |