| SpectraBase Compound ID | IKfWEwYqKOw |
|---|---|
| InChI | InChI=1S/C25H34O12/c1-9-4-14(35-23(32)10(2)6-26)17-11(3)24(33)37-22(17)18-12(5-13(28)16(9)18)8-34-25-21(31)20(30)19(29)15(7-27)36-25/h5,10-11,14-15,17-22,25-27,29-31H,4,6-8H2,1-3H3/t10?,11-,14-,15-,17+,18-,19-,20+,21-,22-,25-/m0/s1 |
| InChIKey | SBVJUODZCWSOMT-VEHNZWOHSA-N |
| Mol Weight | 526.5 g/mol |
| Molecular Formula | C25H34O12 |
| Exact Mass | 526.205027 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BrP7Tcyrdsu |
|---|---|
| Name | CICHORIOSIDE-B-8-O-(3-HYDROXY-2-METHYL)-PROPANOATE;8-O-(3-HYDROXY-2-METHYL)-PROPANOYL-11-BETA,13-DIHYDROLACTUCIN-15-O-BETA-GLUCOPYRANOSIDE |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C25H34O12 |
| InChI | InChI=1S/C25H34O12/c1-9-4-14(35-23(32)10(2)6-26)17-11(3)24(33)37-22(17)18-12(5-13(28)16(9)18)8-34-25-21(31)20(30)19(29)15(7-27)36-25/h5,10-11,14-15,17-22,25-27,29-31H,4,6-8H2,1-3H3/t10?,11-,14-,15-,17+,18-,19-,20+,21-,22-,25-/m0/s1 |
| InChIKey | SBVJUODZCWSOMT-VEHNZWOHSA-N |
| Literature Reference Author | K.MICHALSKA,E.SZNELER,W.KISIEL |
| Literature Reference Citation | MAGN.RES.CHEM.,49,753(2011) |
| Literature Reference DOI | 10.1002/mrc.2801 |
| Molecular Weight | 526.538 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWBT13130 |