| SpectraBase Compound ID | Iq8kN7yg6bz |
|---|---|
| InChI | InChI=1S/C21H38O8/c1-19(2,29-18-17(26)16(25)15(24)12(10-22)28-18)11-5-7-20(3)13(9-11)21(4,27)8-6-14(20)23/h11-18,22-27H,5-10H2,1-4H3/t11-,12+,13-,14-,15+,16-,17+,18-,20-,21-/m0/s1 |
| InChIKey | KAPPVCFMUONHIO-JWUAHDKTSA-N |
| Mol Weight | 418.5 g/mol |
| Molecular Formula | C21H38O8 |
| Exact Mass | 418.256668 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | L72HQ6IIypd |
|---|---|
| Name | CELERIOSIDE-E;EUDESMAN-1-BETA,4-ALPHA,11-TRIOL-11-O-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H38O8 |
| InChI | InChI=1S/C21H38O8/c1-19(2,29-18-17(26)16(25)15(24)12(10-22)28-18)11-5-7-20(3)13(9-11)21(4,27)8-6-14(20)23/h11-18,22-27H,5-10H2,1-4H3/t11-,12+,13-,14-,15+,16-,17+,18-,20-,21-/m0/s1 |
| InChIKey | KAPPVCFMUONHIO-JWUAHDKTSA-N |
| Literature Reference Author | J.KITAJIMA,T.ISHIKAWA,M.SATOH |
| Literature Reference Citation | PHYTOCHEM.,64,1003(2003) |
| Literature Reference DOI | 10.1016/S0031-9422(03)00461-8 |
| Molecular Weight | 418.528 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWKP5774 |