| SpectraBase Compound ID | Le13bgCYvbG |
|---|---|
| InChI | InChI=1S/C27H34O14/c1-36-18-10-15(4-7-17(18)30)24(34)38-12-27(35)13-39-26(23(27)33)41-22-21(32)20(31)19(11-28)40-25(22)37-9-8-14-2-5-16(29)6-3-14/h2-7,10,19-23,25-26,28-33,35H,8-9,11-13H2,1H3/t19-,20-,21+,22-,23+,25-,26+,27-/m1/s1 |
| InChIKey | JCVAJYVLSZBGRV-DVKXAIPJSA-N |
| Mol Weight | 582.6 g/mol |
| Molecular Formula | C27H34O14 |
| Exact Mass | 582.194856 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AweZLQONmyY |
|---|---|
| Name | PHLOMISETHANOSIDE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H34O14 |
| InChI | InChI=1S/C27H34O14/c1-36-18-10-15(4-7-17(18)30)24(34)38-12-27(35)13-39-26(23(27)33)41-22-21(32)20(31)19(11-28)40-25(22)37-9-8-14-2-5-16(29)6-3-14/h2-7,10,19-23,25-26,28-33,35H,8-9,11-13H2,1H3/t19-,20-,21+,22-,23+,25-,26+,27-/m1/s1 |
| InChIKey | JCVAJYVLSZBGRV-DVKXAIPJSA-N |
| Literature Reference Author | Y.TAKEDA,M.KINUGAWA,T.MASUDA,G.HONDA,H.OTSUKA,E.SEZIK,E.YESI LADA |
| Literature Reference Citation | PHYTOCHEM.,51,323(1999) |
| Literature Reference DOI | 10.1016/S0031-9422(98)00734-1 |
| Molecular Weight | 582.559 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWUC291 |