| SpectraBase Compound ID | B0j85CbhKNb |
|---|---|
| InChI | InChI=1S/C47H76O17/c1-22(48)29-12-15-47(54)45(29,7)35(51)21-34-44(6)13-11-28(16-27(44)10-14-46(34,47)53)61-36-17-30(49)41(24(3)58-36)63-39-20-33(56-9)43(26(5)60-39)64-37-18-31(50)42(25(4)59-37)62-38-19-32(55-8)40(52)23(2)57-38/h10,23-26,28-43,49-54H,11-21H2,1-9H3/t23-,24-,25-,26-,28-,29-,30+,31+,32-,33-,34+,35+,36+,37+,38+,39+,40-,41-,42-,43-,44-,45-,46-,47+/m0/s1 |
| InChIKey | VVGUCKCAGBOQNO-FSVNEYHNSA-N |
| Mol Weight | 913.1 g/mol |
| Molecular Formula | C47H76O17 |
| Exact Mass | 912.508251 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FXnyHPnJfOC |
|---|---|
| Name | LINEOLON-3-O-BETA-OLEANDROPYRANOSYL-(1->4)-BETA-DIGITOXOPYRANOSYL-(1->4)-BETA-OLEANDROPYRANOSYL-(1->4)-BETA-DIGITOXOPYRANOSIDE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C47H76O17 |
| InChI | InChI=1S/C47H76O17/c1-22(48)29-12-15-47(54)45(29,7)35(51)21-34-44(6)13-11-28(16-27(44)10-14-46(34,47)53)61-36-17-30(49)41(24(3)58-36)63-39-20-33(56-9)43(26(5)60-39)64-37-18-31(50)42(25(4)59-37)62-38-19-32(55-8)40(52)23(2)57-38/h10,23-26,28-43,49-54H,11-21H2,1-9H3/t23-,24-,25-,26-,28-,29-,30+,31+,32-,33-,34+,35+,36+,37+,38+,39+,40-,41-,42-,43-,44-,45-,46-,47+/m0/s1 |
| InChIKey | VVGUCKCAGBOQNO-FSVNEYHNSA-N |
| Literature Reference Author | T.WARASHINA,T.NORO |
| Literature Reference Citation | PHYTOCHEM.,37,217(1994) |
| Literature Reference DOI | 10.1016/0031-9422(94)85029-1 |
| Molecular Weight | 913.110 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU23047 |