| SpectraBase Compound ID | JN4on7j7SYB |
|---|---|
| InChI | InChI=1S/C31H42O19/c1-14(33)47-19-10-31(44,9-17(35)23(19)39)29(43)50-30(2,11-21(36)37)12-22(38)46-6-4-5-15-7-16(34)27(18(8-15)45-3)49-28-26(42)25(41)24(40)20(13-32)48-28/h4-5,7-8,17,19-20,23-26,28,32,34-35,39-42,44H,6,9-13H2,1-3H3,(H,36,37)/b5-4+/t17-,19-,20+,23-,24+,25-,26+,28-,30?,31+/m1/s1 |
| InChIKey | APFZZFOFVLPZOR-QZMFYBECSA-N |
| Mol Weight | 718.7 g/mol |
| Molecular Formula | C31H42O19 |
| Exact Mass | 718.232029 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9AbtUBt3BM9 |
|---|---|
| Name | WAHLENOSIDE-B |
| Compound Number | 10 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H42O19 |
| InChI | InChI=1S/C31H42O19/c1-14(33)47-19-10-31(44,9-17(35)23(19)39)29(43)50-30(2,11-21(36)37)12-22(38)46-6-4-5-15-7-16(34)27(18(8-15)45-3)49-28-26(42)25(41)24(40)20(13-32)48-28/h4-5,7-8,17,19-20,23-26,28,32,34-35,39-42,44H,6,9-13H2,1-3H3,(H,36,37)/b5-4+/t17-,19-,20+,23-,24+,25-,26+,28-,30?,31+/m1/s1 |
| InChIKey | APFZZFOFVLPZOR-QZMFYBECSA-N |
| Literature Reference Author | R.X.TAN,W.G.MA,H.X.WEI,L.X.ZHANG |
| Literature Reference Citation | PHYTOCHEM.,48,1245(1998) |
| Literature Reference DOI | 10.1016/S0031-9422(97)00928-X |
| Molecular Weight | 718.663 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWMS1458 |