| SpectraBase Compound ID | 8I7lqQq4W5p |
|---|---|
| InChI | InChI=1S/C25H28O12/c1-32-16-10-14(24(31)34-3)11-17(33-2)23(16)37-25-22(30)21(29)20(28)18(36-25)12-35-19(27)9-6-13-4-7-15(26)8-5-13/h4-11,18,20-22,25-26,28-30H,12H2,1-3H3/b9-6+/t18-,20-,21+,22-,25+/m1/s1 |
| InChIKey | RDUGTNPIVFFMRD-XYETXJAPSA-N |
| Mol Weight | 520.49 g/mol |
| Molecular Formula | C25H28O12 |
| Exact Mass | 520.158076 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | G9u3HCNp2e4 |
|---|---|
| Name | METHYL-6''-O-(E)-PARA-HYDROXY-CINNAMOXYL-GLUCOSYRINGATE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C25H28O12 |
| InChI | InChI=1S/C25H28O12/c1-32-16-10-14(24(31)34-3)11-17(33-2)23(16)37-25-22(30)21(29)20(28)18(36-25)12-35-19(27)9-6-13-4-7-15(26)8-5-13/h4-11,18,20-22,25-26,28-30H,12H2,1-3H3/b9-6+/t18-,20-,21+,22-,25+/m1/s1 |
| InChIKey | RDUGTNPIVFFMRD-XYETXJAPSA-N |
| Literature Reference Author | J.X.LIU,D.L.DI,Y.P.SHI |
| Literature Reference Citation | J.CHIN.CHEM.SOC.,55,863(2008) |
| Literature Reference DOI | 10.1002/jccs.200800129 |
| Molecular Weight | 520.490 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWIR15617 |