![KAEMPFEROL-3-O-BETA-D-[2E-PARA-COUMAROYL-BETA-D-GLUCOPYRANOSYL-(1->2)-GLUCOPYRANOSIDE]-7-O-BETA-D-GLUCOPYRANOSIDE](/api/spectrum/CQhnbfp6ZyW/structure.png?h=300&w=458 "KAEMPFEROL-3-O-BETA-D-[2E-PARA-COUMAROYL-BETA-D-GLUCOPYRANOSYL-(1->2)-GLUCOPYRANOSIDE]-7-O-BETA-D-GLUCOPYRANOSIDE")
| SpectraBase Compound ID | FDyV7gZyQgQ |
|---|---|
| InChI | InChI=1S/C42H46O23/c43-13-23-28(50)32(54)35(57)40(60-23)58-20-11-21(48)27-22(12-20)59-36(17-4-8-19(47)9-5-17)37(31(27)53)64-42-39(34(56)30(52)25(15-45)62-42)65-41-38(33(55)29(51)24(14-44)61-41)63-26(49)10-3-16-1-6-18(46)7-2-16/h1-12,23-25,28-30,32-35,38-48,50-52,54-57H,13-15H2/b10-3+/t23-,24+,25+,28-,29+,30+,32+,33-,34-,35-,38+,39+,40-,41-,42-/m0/s1 |
| InChIKey | CSGSYHAZGDVQGA-ONDQUVEYSA-N |
| Mol Weight | 918.8 g/mol |
| Molecular Formula | C42H46O23 |
| Exact Mass | 918.242988 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CQhnbfp6ZyW |
|---|---|
| Name | KAEMPFEROL-3-O-BETA-D-[2E-PARA-COUMAROYL-BETA-D-GLUCOPYRANOSYL-(1->2)-GLUCOPYRANOSIDE]-7-O-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C42H46O23 |
| InChI | InChI=1S/C42H46O23/c43-13-23-28(50)32(54)35(57)40(60-23)58-20-11-21(48)27-22(12-20)59-36(17-4-8-19(47)9-5-17)37(31(27)53)64-42-39(34(56)30(52)25(15-45)62-42)65-41-38(33(55)29(51)24(14-44)61-41)63-26(49)10-3-16-1-6-18(46)7-2-16/h1-12,23-25,28-30,32-35,38-48,50-52,54-57H,13-15H2/b10-3+/t23-,24+,25+,28-,29+,30+,32+,33-,34-,35-,38+,39+,40-,41-,42-/m0/s1 |
| InChIKey | CSGSYHAZGDVQGA-ONDQUVEYSA-N |
| Literature Reference Author | J.K.NIELSEN,C.E.OLSEN,M.K.PETERSEN |
| Literature Reference Citation | PHYTOCHEM.,34,539(1993) |
| Literature Reference DOI | 10.1016/0031-9422(93)80042-Q |
| Molecular Weight | 918.813 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWLU7384 |