| SpectraBase Compound ID | Hx5ZbiWD1mq |
|---|---|
| InChI | InChI=1S/C28H36O17/c1-11(29)37-9-17-7-8-18-20(17)26(44-27(42-16(6)34)21(18)25(35)36)45-28-24(41-15(5)33)23(40-14(4)32)22(39-13(3)31)19(43-28)10-38-12(2)30/h7-8,17-24,26-28H,9-10H2,1-6H3,(H,35,36)/t17-,18+,19+,20-,21-,22+,23-,24+,26+,27+,28-/m1/s1 |
| InChIKey | JHEWUXPDJRGIHP-BKTRNCQSSA-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 | 5jmh5cmqL6m |
|---|---|
| Name | FORMOSINOSIDE-1-HEXAACETATE |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H36O17 |
| InChI | InChI=1S/C28H36O17/c1-11(29)37-9-17-7-8-18-20(17)26(44-27(42-16(6)34)21(18)25(35)36)45-28-24(41-15(5)33)23(40-14(4)32)22(39-13(3)31)19(43-28)10-38-12(2)30/h7-8,17-24,26-28H,9-10H2,1-6H3,(H,35,36)/t17-,18+,19+,20-,21-,22+,23-,24+,26+,27+,28-/m1/s1 |
| InChIKey | JHEWUXPDJRGIHP-BKTRNCQSSA-N |
| Literature Reference Author | V.D.S.BOLZANI,C.M.IZUMISAWA,M.C.M.YOUNG,L.M.V.TREVISAN,D.G.I .KINGSTON,A.L.GUNATI |
| Literature Reference Citation | PHYTOCHEM.,46,305(1997) |
| Literature Reference DOI | 10.1016/s0031-9422(97)00238-0 |
| Molecular Weight | 644.584 g/mol |
| Sample ID | 44844 |
| Solvent | CDCl3 |