![QUERCETIN-3-METHYLETHER-7-O-BETA-D-GLUCOPYRANOSYL-[(1->6)-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-ALPHA-L-RHAMNOPYRANOSYL]-(1->2)-BETA-D-XYLOPYRANOSIDE](/api/spectrum/4EHF82knuyO/structure.png?h=300&w=458 "QUERCETIN-3-METHYLETHER-7-O-BETA-D-GLUCOPYRANOSYL-[(1->6)-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-ALPHA-L-RHAMNOPYRANOSYL]-(1->2)-BETA-D-XYLOPYRANOSIDE")
| SpectraBase Compound ID | DylwzINpgY0 |
|---|---|
| InChI | InChI=1S/C39H50O24/c1-11-22(44)27(49)31(53)37(57-11)63-34-28(50)23(45)12(2)58-38(34)56-10-20-25(47)29(51)35(62-36-30(52)24(46)18(43)9-55-36)39(61-20)59-14-7-17(42)21-19(8-14)60-32(33(54-3)26(21)48)13-4-5-15(40)16(41)6-13/h4-8,11-12,18,20,22-25,27-31,34-47,49-53H,9-10H2,1-3H3/t11-,12-,18+,20+,22-,23-,24-,25+,27+,28+,29-,30+,31+,34+,35+,36-,37+,38-,39+/m1/s1 |
| InChIKey | YIHMVYISFSXBKT-MPAMUCFXSA-N |
| Mol Weight | 902.8 g/mol |
| Molecular Formula | C39H50O24 |
| Exact Mass | 902.269202 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4EHF82knuyO |
|---|---|
| Name | QUERCETIN-3-METHYLETHER-7-O-BETA-D-GLUCOPYRANOSYL-[(1->6)-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-ALPHA-L-RHAMNOPYRANOSYL]-(1->2)-BETA-D-XYLOPYRANOSIDE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C39H50O24 |
| InChI | InChI=1S/C39H50O24/c1-11-22(44)27(49)31(53)37(57-11)63-34-28(50)23(45)12(2)58-38(34)56-10-20-25(47)29(51)35(62-36-30(52)24(46)18(43)9-55-36)39(61-20)59-14-7-17(42)21-19(8-14)60-32(33(54-3)26(21)48)13-4-5-15(40)16(41)6-13/h4-8,11-12,18,20,22-25,27-31,34-47,49-53H,9-10H2,1-3H3/t11-,12-,18+,20+,22-,23-,24-,25+,27+,28+,29-,30+,31+,34+,35+,36-,37+,38-,39+/m1/s1 |
| InChIKey | YIHMVYISFSXBKT-MPAMUCFXSA-N |
| Literature Reference Author | N.DETOMMASI,S.PIACENTE,C.PIZZA |
| Literature Reference Citation | J.NAT.PROD.,61,973(1998) |
| Literature Reference DOI | 10.1021/np970470f |
| Molecular Weight | 902.812 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWRK3407 |