| SpectraBase Compound ID | 2TmVTKaXJ5D |
|---|---|
| InChI | InChI=1S/C29H34O16/c1-12-22(37)23(38)24(39)29(42-12)45-27-25(40)28(41-11-19(35)14-4-6-16(32)18(34)9-14)43-20(10-30)26(27)44-21(36)7-3-13-2-5-15(31)17(33)8-13/h2-9,12,20,22-34,37-40H,10-11H2,1H3/b7-3+/t12-,20-,22-,23+,24+,25-,26-,27-,28-,29-/m0/s1 |
| InChIKey | QKMLPSOMRMIAPR-DQWZYSQBSA-N |
| Mol Weight | 638.6 g/mol |
| Molecular Formula | C29H34O16 |
| Exact Mass | 638.184685 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4zXASO46V0c |
|---|---|
| Name | BETA-OXOACETOSIDE;BETA-OXO-BETA-(3,4-DIHYDORXYPHEYNL)-ETHYL-O-ALPHA-L-RHAMNOPYRANOSYL-(1->3)-BETA-D-(4-O-CAFFEOYL)-GLUCOPYRANOSIDE |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H34O16 |
| InChI | InChI=1S/C29H34O16/c1-12-22(37)23(38)24(39)29(42-12)45-27-25(40)28(41-11-19(35)14-4-6-16(32)18(34)9-14)43-20(10-30)26(27)44-21(36)7-3-13-2-5-15(31)17(33)8-13/h2-9,12,20,22-34,37-40H,10-11H2,1H3/b7-3+/t12-,20-,22-,23+,24+,25-,26-,27-,28-,29-/m0/s1 |
| InChIKey | QKMLPSOMRMIAPR-DQWZYSQBSA-N |
| Literature Reference Author | S.NISHIBE,M.SASAHARA,J.YIANG,Y.C.LU,T.TANAKA |
| Literature Reference Citation | PHYTOCHEM.,32,975(1993) |
| Literature Reference DOI | 10.1016/0031-9422(93)85238-M |
| Molecular Weight | 638.579 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWLU6273 |