| SpectraBase Compound ID | BpWwCKmrYxo |
|---|---|
| InChI | InChI=1S/C42H64O17/c1-20-36(58-32-15-28(52-4)37(21(2)55-32)59-38-35(49)34(48)33(47)29(17-43)57-38)27(45)14-31(54-20)56-23-5-10-40(19-44)25-6-9-39(3)24(22-13-30(46)53-18-22)8-12-42(39,51)26(25)7-11-41(40,50)16-23/h13,19-21,23-29,31-38,43,45,47-51H,5-12,14-18H2,1-4H3/t20-,21+,23+,24?,25?,26?,27+,28-,29-,31+,32+,33-,34+,35-,36-,37+,38+,39-,40+,41+,42+/m0/s1 |
| InChIKey | YNIHVLPYSXTVDC-CMNFWOTASA-N |
| Mol Weight | 841.0 g/mol |
| Molecular Formula | C42H64O17 |
| Exact Mass | 840.414351 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6Cw84uISc9I |
|---|---|
| Name | STROPHANTHIDIN-3-O-beta-D-DIGITOXOSIDO-alpha-L-CYMAROSIDO-beta-D-GLUCOSIDE |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C42H64O17 |
| InChI | InChI=1S/C42H64O17/c1-20-36(58-32-15-28(52-4)37(21(2)55-32)59-38-35(49)34(48)33(47)29(17-43)57-38)27(45)14-31(54-20)56-23-5-10-40(19-44)25-6-9-39(3)24(22-13-30(46)53-18-22)8-12-42(39,51)26(25)7-11-41(40,50)16-23/h13,19-21,23-29,31-38,43,45,47-51H,5-12,14-18H2,1-4H3/t20-,21+,23+,24?,25?,26?,27+,28-,29-,31+,32+,33-,34+,35-,36-,37+,38+,39-,40+,41+,42+/m0/s1 |
| InChIKey | YNIHVLPYSXTVDC-CMNFWOTASA-N |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |