| SpectraBase Compound ID | 9HjvifO3ZjB |
|---|---|
| InChI | InChI=1S/C31H44O14/c1-15(27(39)42-3)18-8-10-30(2)21(45-28(40)19(34)12-16-4-6-17(33)7-5-16)9-11-31(41,26(30)22(18)35)14-43-29-25(38)24(37)23(36)20(13-32)44-29/h4-7,18-26,29,32-38,41H,1,8-14H2,2-3H3/t18-,19?,20-,21+,22-,23-,24+,25-,26+,29-,30-,31+/m0/s1 |
| InChIKey | HQGIZPPLRDFZMV-IIYGSMPCSA-N |
| Mol Weight | 640.7 g/mol |
| Molecular Formula | C31H44O14 |
| Exact Mass | 640.273106 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GDlxIHRGDON |
|---|---|
| Name | IXERISOSIDE-K |
| Compound Number | 25 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H44O14 |
| InChI | InChI=1S/C31H44O14/c1-15(27(39)42-3)18-8-10-30(2)21(45-28(40)19(34)12-16-4-6-17(33)7-5-16)9-11-31(41,26(30)22(18)35)14-43-29-25(38)24(37)23(36)20(13-32)44-29/h4-7,18-26,29,32-38,41H,1,8-14H2,2-3H3/t18-,19?,20-,21+,22-,23-,24+,25-,26+,29-,30-,31+/m0/s1 |
| InChIKey | HQGIZPPLRDFZMV-IIYGSMPCSA-N |
| Literature Reference Author | T.WARASHINA,M.ISHINO,T.MIYASE,A.UENO |
| Literature Reference Citation | PHYTOCHEM.,29,3217(1990) |
| Literature Reference DOI | 10.1016/0031-9422(90)80188-M |
| Molecular Weight | 640.682 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UWKP6860 |