![QUERCETIN-3-O-BETA-D-[2-(E)-5-HYDROXYFERULOYL-BETA-D-GLUCOPYRANOSYL-(1->2)-GLUCOPYRANOSIDE]-7-O-BETA-D-GLUCOPYRANOSIDE](/api/spectrum/1LIvF2gvaPy/structure.png?h=300&w=458 "QUERCETIN-3-O-BETA-D-[2-(E)-5-HYDROXYFERULOYL-BETA-D-GLUCOPYRANOSYL-(1->2)-GLUCOPYRANOSIDE]-7-O-BETA-D-GLUCOPYRANOSIDE")
| SpectraBase Compound ID | ARRAfACELe3 |
|---|---|
| InChI | InChI=1S/C43H48O26/c1-61-22-7-14(6-20(50)28(22)52)2-5-26(51)67-39-34(58)30(54)24(12-45)65-42(39)69-40-35(59)31(55)25(13-46)66-43(40)68-38-32(56)27-19(49)9-16(62-41-36(60)33(57)29(53)23(11-44)64-41)10-21(27)63-37(38)15-3-4-17(47)18(48)8-15/h2-10,23-25,29-31,33-36,39-50,52-55,57-60H,11-13H2,1H3/b5-2+/t23-,24+,25+,29-,30+,31+,33+,34-,35-,36-,39+,40+,41-,42-,43-/m0/s1 |
| InChIKey | DCGZOHBBHJZTMS-CPTVPIIHSA-N |
| Mol Weight | 980.8 g/mol |
| Molecular Formula | C43H48O26 |
| Exact Mass | 980.243382 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1LIvF2gvaPy |
|---|---|
| Name | QUERCETIN-3-O-BETA-D-[2-(E)-5-HYDROXYFERULOYL-BETA-D-GLUCOPYRANOSYL-(1->2)-GLUCOPYRANOSIDE]-7-O-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 19N |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C43H48O26 |
| InChI | InChI=1S/C43H48O26/c1-61-22-7-14(6-20(50)28(22)52)2-5-26(51)67-39-34(58)30(54)24(12-45)65-42(39)69-40-35(59)31(55)25(13-46)66-43(40)68-38-32(56)27-19(49)9-16(62-41-36(60)33(57)29(53)23(11-44)64-41)10-21(27)63-37(38)15-3-4-17(47)18(48)8-15/h2-10,23-25,29-31,33-36,39-50,52-55,57-60H,11-13H2,1H3/b5-2+/t23-,24+,25+,29-,30+,31+,33+,34-,35-,36-,39+,40+,41-,42-,43-/m0/s1 |
| InChIKey | DCGZOHBBHJZTMS-CPTVPIIHSA-N |
| Literature Reference Author | M.S.C.PEDRAS,Q.A.ZHENG,R.S.GADAGI,S.R.RIMMER |
| Literature Reference Citation | PHYTOCHEM.,69,894(2008) |
| Literature Reference DOI | 10.1016/j.phytochem.2007.10.019 |
| Molecular Weight | 980.839 g/mol |
| Sample ID | 43224 |
| Solvent | D2O |