| SpectraBase Compound ID | 8bFPEprIZkg |
|---|---|
| InChI | InChI=1S/C25H36O13/c1-3-4-13(2)37-23-21(31)20(30)19(29)17(38-23)10-34-24-22(32)25(33,12-36-24)11-35-18(28)8-6-14-5-7-15(26)16(27)9-14/h5-9,13,17,19-24,26-27,29-33H,3-4,10-12H2,1-2H3/b8-6+/t13-,17+,19+,20-,21+,22+,23+,24-,25-/m1/s1 |
| InChIKey | JEOODUYTNFLEHG-DXIPLXFHSA-N |
| Mol Weight | 544.6 g/mol |
| Molecular Formula | C25H36O13 |
| Exact Mass | 544.215591 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JyJwpyIo2Aw |
|---|---|
| Name | DRACUNCULIFOSIDE-Q |
| Compound Number | 11 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C25H36O13 |
| InChI | InChI=1S/C25H36O13/c1-3-4-13(2)37-23-21(31)20(30)19(29)17(38-23)10-34-24-22(32)25(33,12-36-24)11-35-18(28)8-6-14-5-7-15(26)16(27)9-14/h5-9,13,17,19-24,26-27,29-33H,3-4,10-12H2,1-2H3/b8-6+/t13-,17+,19+,20-,21+,22+,23+,24-,25-/m1/s1 |
| InChIKey | JEOODUYTNFLEHG-DXIPLXFHSA-N |
| Literature Reference Author | Y.NAGATANI,T.WARASHINA,T.NORO |
| Literature Reference Citation | CHEM.PHARM.BULL.,50,583(2002) |
| Literature Reference DOI | 10.1248/cpb.50.583 |
| Molecular Weight | 544.553 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWVN8124 |