| SpectraBase Compound ID | BJjZwfSYiHJ |
|---|---|
| InChI | InChI=1S/C35H54O10/c1-18-31(39)26(36)15-30(42-18)45-32-19(2)43-29(16-27(32)37)44-22-7-10-33(3)21(14-22)5-6-25-24(33)8-11-34(4)23(9-12-35(25,34)40)20-13-28(38)41-17-20/h13,18-19,21-27,29-32,36-37,39-40H,5-12,14-17H2,1-4H3/t18-,19-,21-,22-,23+,24-,25+,26+,27-,29+,30+,31-,32-,33-,34+,35-/m0/s1 |
| InChIKey | CERUVRSAHAFOLZ-SYLQNPJKSA-N |
| Mol Weight | 634.8 g/mol |
| Molecular Formula | C35H54O10 |
| Exact Mass | 634.371698 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LsteRy1CVBe |
|---|---|
| Name | BIS-DIGITOXIGENINDIGITOXOSIDE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C35H54O10 |
| InChI | InChI=1S/C35H54O10/c1-18-31(39)26(36)15-30(42-18)45-32-19(2)43-29(16-27(32)37)44-22-7-10-33(3)21(14-22)5-6-25-24(33)8-11-34(4)23(9-12-35(25,34)40)20-13-28(38)41-17-20/h13,18-19,21-27,29-32,36-37,39-40H,5-12,14-17H2,1-4H3/t18-,19-,21-,22-,23+,24-,25+,26+,27-,29+,30+,31-,32-,33-,34+,35-/m0/s1 |
| InChIKey | CERUVRSAHAFOLZ-SYLQNPJKSA-N |
| Literature Reference Author | T.DRAKENBERG,P.BRODELIUS,D.D.MCINTYRE,H.J.VOGEL |
| Literature Reference Citation | CAN.J.CHEM.,68,272(1990) |
| Literature Reference DOI | 10.1139/v90-037 |
| Molecular Weight | 634.808 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWED10536 |