| SpectraBase Compound ID | 8xkbtjALJKI |
|---|---|
| InChI | InChI=1S/C37H42O20/c1-18(38)50-17-29-32(53-20(3)40)33(54-21(4)41)34(55-22(5)42)37(56-29)57-36-24(25(15-31(44)48-7)26(16-51-36)35(45)46)12-13-49-30(43)11-9-23-8-10-27(52-19(2)39)28(14-23)47-6/h8-12,14,16,25,29,32-34,36-37H,13,15,17H2,1-7H3,(H,45,46)/b11-9+,24-12+/t25-,29+,32+,33-,34+,36-,37-/m0/s1 |
| InChIKey | ZDEXSWYPZDECAG-WTTSHIORSA-N |
| Mol Weight | 806.7 g/mol |
| Molecular Formula | C37H42O20 |
| Exact Mass | 806.226944 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8HUH5cO4A5f |
|---|---|
| Name | JASLANCEOSIDE_A_PENTAACETATE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C37H42O20 |
| InChI | InChI=1S/C37H42O20/c1-18(38)50-17-29-32(53-20(3)40)33(54-21(4)41)34(55-22(5)42)37(56-29)57-36-24(25(15-31(44)48-7)26(16-51-36)35(45)46)12-13-49-30(43)11-9-23-8-10-27(52-19(2)39)28(14-23)47-6/h8-12,14,16,25,29,32-34,36-37H,13,15,17H2,1-7H3,(H,45,46)/b11-9+,24-12+/t25-,29+,32+,33-,34+,36-,37-/m0/s1 |
| InChIKey | ZDEXSWYPZDECAG-WTTSHIORSA-N |
| Literature Reference Author | Y.-C.SHEN,S.-L.LIN |
| Literature Reference Citation | PLANTA.MED.,62,515(1996) |
| Literature Reference DOI | 10.1055/s-2006-957960 |
| Molecular Weight | 806.728 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UIAP864 |