| SpectraBase Compound ID | DF6jjILtrdr |
|---|---|
| InChI | InChI=1S/C37H52O13/c1-12-18(6)33(41)46-28-22(10)44-36(27(40)26(28)39)50-31-29(47-34(42)19(7)13-2)23(11)45-37(32(31)48-35(43)20(8)14-3)49-30-24(17(4)5)16-15-21(9)25(30)38/h12-17,22-23,26-29,31-32,36-40H,1-11H3/b18-12-,19-13-,20-14+/t22-,23-,26-,27-,28+,29+,31+,32-,36+,37+/m1/s1 |
| InChIKey | UQRWIQQTMLSUAF-HVYQPCFGSA-N |
| Mol Weight | 704.8 g/mol |
| Molecular Formula | C37H52O13 |
| Exact Mass | 704.340792 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JYjYi7ppL6o |
|---|---|
| Name | 2-HYDROXYTHYMOL-3-O-(4-O-ANGELOYL-BETA-D-FUCOPYRANOSYL)-(1->3)-(2,4-DI-O-ANGELOYL)-BETA-D-FUCOPYRANOSIDE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C37H52O13 |
| InChI | InChI=1S/C37H52O13/c1-12-18(6)33(41)46-28-22(10)44-36(27(40)26(28)39)50-31-29(47-34(42)19(7)13-2)23(11)45-37(32(31)48-35(43)20(8)14-3)49-30-24(17(4)5)16-15-21(9)25(30)38/h12-17,22-23,26-29,31-32,36-40H,1-11H3/b18-12-,19-13-,20-14+/t22-,23-,26-,27-,28+,29+,31+,32-,36+,37+/m1/s1 |
| InChIKey | UQRWIQQTMLSUAF-HVYQPCFGSA-N |
| Literature Reference Author | J.HUETHER,C.M.PASSREITER,V.WRAY,G.WILLUHN |
| Literature Reference Citation | PHYTOCHEM.,51,979(1999) |
| Literature Reference DOI | 10.1016/S0031-9422(98)00700-6 |
| Molecular Weight | 704.812 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWVN960 |