| SpectraBase Compound ID | 2Yu0oil3RZd |
|---|---|
| InChI | InChI=1S/C27H28O14/c28-15-6-8-17(14(10-15)11-39-26(36)27(37)19(30)9-7-16(29)23(27)34)40-25-22(33)21(32)20(31)18(41-25)12-38-24(35)13-4-2-1-3-5-13/h1-10,18-23,25,28,30-34,37H,11-12H2/t18-,19-,20-,21+,22-,23+,25-,27-/m1/s1 |
| InChIKey | IWFAUYRWNZUFAQ-MUZBHQQFSA-N |
| Mol Weight | 576.51 g/mol |
| Molecular Formula | C27H28O14 |
| Exact Mass | 576.147906 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EpwbzLqTx1G |
|---|---|
| Name | (REL)-2-(6-BENZOYL-BETA-GLUCOPYRANOSYLOXY)-7-(6-ALPHA,2-ALPHA,6-ALPHA-TRIHYDROXY-5-OXOCYClOHEX-3-ENOYL)-5-HYDROXYBENZYL_ALCOHOL |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H28O14 |
| InChI | InChI=1S/C27H28O14/c28-15-6-8-17(14(10-15)11-39-26(36)27(37)19(30)9-7-16(29)23(27)34)40-25-22(33)21(32)20(31)18(41-25)12-38-24(35)13-4-2-1-3-5-13/h1-10,18-23,25,28,30-34,37H,11-12H2/t18-,19-,20-,21+,22-,23+,25-,27-/m1/s1 |
| InChIKey | IWFAUYRWNZUFAQ-MUZBHQQFSA-N |
| Literature Reference Author | K.SHAARI,P.G.WATERMAN |
| Literature Reference Citation | PHYTOCHEM.,39,1415(1995) |
| Literature Reference DOI | 10.1016/0031-9422(95)00136-U |
| Molecular Weight | 576.511 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMZ7842 |