| SpectraBase Compound ID | 768nzDE7vpn |
|---|---|
| InChI | InChI=1S/C28H36O17/c1-11(29)37-10-19-22(39-13(3)31)25(42-16(6)34)26(43-17(7)35)28(44-19)45-27-20-18(8-9-36-27)21(38-12(2)30)24(41-15(5)33)23(20)40-14(4)32/h8-9,18-28H,10H2,1-7H3/t18-,19+,20?,21+,22+,23-,24-,25-,26+,27+,28-/m1/s1 |
| InChIKey | YCQQAGIDZJJPTK-UGBHYSAOSA-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 | KkZ84AqXAe |
|---|---|
| Name | 5-DEOXYHOLMIOSIDE-HEPTAACETATE |
| Compound Number | 6A |
| 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)37-10-19-22(39-13(3)31)25(42-16(6)34)26(43-17(7)35)28(44-19)45-27-20-18(8-9-36-27)21(38-12(2)30)24(41-15(5)33)23(20)40-14(4)32/h8-9,18-28H,10H2,1-7H3/t18-,19+,20?,21+,22+,23-,24-,25-,26+,27+,28-/m1/s1 |
| InChIKey | YCQQAGIDZJJPTK-UGBHYSAOSA-N |
| Literature Reference Author | S.DAMTOFT,H.FRANZYK,S.R.JENSEN,B.J.NIELSEN |
| Literature Reference Citation | PHYTOCHEM.,34,239(1993) |
| Literature Reference DOI | 10.1016/S0031-9422(00)90811-2 |
| Molecular Weight | 644.584 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU7245 |