![QUERCETIN-3-O-[BETA]-D-GLUCOPYRANOSIDE-7-O-(6-E-P-COUMAROYL)-[BETA]-D-GLUCOPYRANOSYL-(1-3)-[ALPHA]-L-RHAMNOPYRANOSIDE](/api/spectrum/8ESqe6lvcfz/structure.png?h=300&w=458 "QUERCETIN-3-O-[BETA]-D-GLUCOPYRANOSIDE-7-O-(6-E-P-COUMAROYL)-[BETA]-D-GLUCOPYRANOSYL-(1-3)-[ALPHA]-L-RHAMNOPYRANOSIDE")
| SpectraBase Compound ID | 22VKhmpFN3Y |
|---|---|
| InChI | InChI=1S/C42H46O23/c1-15-28(49)38(64-41-35(56)33(54)30(51)25(63-41)14-58-26(48)9-4-16-2-6-18(44)7-3-16)36(57)42(59-15)60-19-11-22(47)27-23(12-19)61-37(17-5-8-20(45)21(46)10-17)39(31(27)52)65-40-34(55)32(53)29(50)24(13-43)62-40/h2-12,15,24-25,28-30,32-36,38,40-47,49-51,53-57H,13-14H2,1H3/b9-4+/t15-,24-,25+,28-,29-,30+,32+,33-,34-,35+,36+,38+,40+,41-,42-/m1/s1 |
| InChIKey | GIZUXLUTUNKVHX-MKKPBUBZSA-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 | 8ESqe6lvcfz |
|---|---|
| Name | QUERCETIN-3-O-[BETA]-D-GLUCOPYRANOSIDE-7-O-(6-E-P-COUMAROYL)-[BETA]-D-GLUCOPYRANOSYL-(1-3)-[ALPHA]-L-RHAMNOPYRANOSIDE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C42H46O23 |
| InChI | InChI=1S/C42H46O23/c1-15-28(49)38(64-41-35(56)33(54)30(51)25(63-41)14-58-26(48)9-4-16-2-6-18(44)7-3-16)36(57)42(59-15)60-19-11-22(47)27-23(12-19)61-37(17-5-8-20(45)21(46)10-17)39(31(27)52)65-40-34(55)32(53)29(50)24(13-43)62-40/h2-12,15,24-25,28-30,32-36,38,40-47,49-51,53-57H,13-14H2,1H3/b9-4+/t15-,24-,25+,28-,29-,30+,32+,33-,34-,35+,36+,38+,40+,41-,42-/m1/s1 |
| InChIKey | GIZUXLUTUNKVHX-MKKPBUBZSA-N |
| Literature Reference Author | S.VITALINI,A.BRACA,D.PASSARELLA,G.FICO |
| Literature Reference Citation | FITOTERAPIA,81,940(2010) |
| Literature Reference DOI | 10.1016/j.fitote.2010.06.012 |
| Molecular Weight | 918.813 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWMB1188 |