| SpectraBase Compound ID | 6H6Y3V0nymS |
|---|---|
| InChI | InChI=1S/C21H36O8/c1-10-7-13(23)18(27)21(4)6-5-11(8-12(10)21)20(2,3)29-19-17(26)16(25)15(24)14(9-22)28-19/h11-19,22-27H,1,5-9H2,2-4H3/t11-,12+,13+,14+,15+,16-,17+,18-,19-,21+/m1/s1 |
| InChIKey | LHONWXPQABNHFF-DHFFQXDZSA-N |
| Mol Weight | 416.5 g/mol |
| Molecular Formula | C21H36O8 |
| Exact Mass | 416.241018 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Inq5pEEy3tN |
|---|---|
| Name | CELERIOSIDE-D;EUDESMAN-4(15)-ENE-1-BETA,2-ALPHA,11-TRIOL-11-O-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H36O8 |
| InChI | InChI=1S/C21H36O8/c1-10-7-13(23)18(27)21(4)6-5-11(8-12(10)21)20(2,3)29-19-17(26)16(25)15(24)14(9-22)28-19/h11-19,22-27H,1,5-9H2,2-4H3/t11-,12+,13+,14+,15+,16-,17+,18-,19-,21+/m1/s1 |
| InChIKey | LHONWXPQABNHFF-DHFFQXDZSA-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 | 416.512 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWKP5773 |