| SpectraBase Compound ID | 1SE3kU5tIyb |
|---|---|
| InChI | InChI=1S/C28H36O17/c29-7-15-18(32)20(34)23(37)27(43-15)45-25-17-13(5-6-28(17,39)10-30)14(8-41-25)24(38)40-9-16-19(33)21(35)22(36)26(44-16)42-12-3-1-11(31)2-4-12/h1-6,8,13,15-23,25-27,29-37,39H,7,9-10H2/t13?,15-,16-,17?,18-,19-,20+,21+,22-,23-,25-,26-,27+,28-/m0/s1 |
| InChIKey | SWPCUCSDISESSE-AHSFZMCOSA-N |
| Mol Weight | 644.6 g/mol |
| Molecular Formula | C28H36O17 |
| Exact Mass | 644.19525 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | F4tgOUMA3t4 |
|---|---|
| Name | DUNALIANOSIDE-I |
| Compound Number | 9 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H36O17 |
| InChI | InChI=1S/C28H36O17/c29-7-15-18(32)20(34)23(37)27(43-15)45-25-17-13(5-6-28(17,39)10-30)14(8-41-25)24(38)40-9-16-19(33)21(35)22(36)26(44-16)42-12-3-1-11(31)2-4-12/h1-6,8,13,15-23,25-27,29-37,39H,7,9-10H2/t13?,15-,16-,17?,18-,19-,20+,21+,22-,23-,25-,26-,27+,28-/m0/s1 |
| InChIKey | SWPCUCSDISESSE-AHSFZMCOSA-N |
| Literature Reference Author | P.ZHAO,T.TANAKA,K.HIRABAYASHI,Y.J.ZHANG,C.R.YANG,I.KOUNO |
| Literature Reference Citation | PHYTOCHEM.,69,3087(2008) |
| Literature Reference DOI | 10.1016/j.phytochem.2008.06.001 |
| Molecular Weight | 644.584 g/mol |
| Sample ID | 63876 |
| Solvent | CD3OD |