![1-(2,3,4-TRIHYDROXYPHENYL)-ETHYL-3-O-RHAMNOSE-4-[(2E)-3-(3,4-DIHYDROXYPHENYL)-2-PROPENOALTE]-GLUCOPYRANOSIDE](/api/spectrum/7PRNGqHsUSI/structure.png?h=300&w=458 "1-(2,3,4-TRIHYDROXYPHENYL)-ETHYL-3-O-RHAMNOSE-4-[(2E)-3-(3,4-DIHYDROXYPHENYL)-2-PROPENOALTE]-GLUCOPYRANOSIDE")
| SpectraBase Compound ID | F1rs9gm4D4S |
|---|---|
| InChI | InChI=1S/C29H36O16/c1-12-20(35)23(38)24(39)29(42-12)45-27-25(40)28(41-9-8-14-4-6-16(32)22(37)21(14)36)43-18(11-30)26(27)44-19(34)7-3-13-2-5-15(31)17(33)10-13/h2-7,10,12,18,20,23-33,35-40H,8-9,11H2,1H3/b7-3+/t12-,18-,20-,23+,24+,25-,26-,27-,28-,29-/m0/s1 |
| InChIKey | YYZHLHNSALTWST-UYSATDPYSA-N |
| Mol Weight | 640.6 g/mol |
| Molecular Formula | C29H36O16 |
| Exact Mass | 640.200335 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7PRNGqHsUSI |
|---|---|
| Name | 1-(2,3,4-TRIHYDROXYPHENYL)-ETHYL-3-O-RHAMNOSE-4-[(2E)-3-(3,4-DIHYDROXYPHENYL)-2-PROPENOALTE]-GLUCOPYRANOSIDE |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H36O16 |
| InChI | InChI=1S/C29H36O16/c1-12-20(35)23(38)24(39)29(42-12)45-27-25(40)28(41-9-8-14-4-6-16(32)22(37)21(14)36)43-18(11-30)26(27)44-19(34)7-3-13-2-5-15(31)17(33)10-13/h2-7,10,12,18,20,23-33,35-40H,8-9,11H2,1H3/b7-3+/t12-,18-,20-,23+,24+,25-,26-,27-,28-,29-/m0/s1 |
| InChIKey | YYZHLHNSALTWST-UYSATDPYSA-N |
| Literature Reference Author | B.B.ZHANG,K.SHI,Z.X.LIAO,Y.DAI,Z.H.ZOU |
| Literature Reference Citation | FITOTERAPIA,82,854(2011) |
| Literature Reference DOI | 10.1016/j.fitote.2011.04.005 |
| Molecular Weight | 640.595 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWDB1051 |