![ISOVITEXIN-2''-O-BETA-[6-O-E-PARA-COUMAROYLGLUCOPYRANOSIDE]](/api/spectrum/1nbUFgf61lu/structure.png?h=300&w=458 "ISOVITEXIN-2''-O-BETA-[6-O-E-PARA-COUMAROYLGLUCOPYRANOSIDE]")
| SpectraBase Compound ID | 7TW1QHqchFf |
|---|---|
| InChI | InChI=1S/2C36H36O17/c2*37-13-23-28(43)32(47)35(53-36-33(48)31(46)29(44)24(52-36)14-49-25(42)10-3-15-1-6-17(38)7-2-15)34(51-23)27-20(41)12-22-26(30(27)45)19(40)11-21(50-22)16-4-8-18(39)9-5-16/h2*1-12,23-24,28-29,31-39,41,43-48H,13-14H2/b2*10-3+/t2*23-,24-,28-,29-,31+,32+,33-,34+,35-,36+/m10/s1 |
| InChIKey | QIZNGJGOVSESRL-QLTOUKIASA-N |
| Mol Weight | 1481.3 g/mol |
| Molecular Formula | C72H72O34 |
| Exact Mass | 1480.390499 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1nbUFgf61lu |
|---|---|
| Name | ISOVITEXIN-2''-O-BETA-[6-O-E-PARA-COUMAROYLGLUCOPYRANOSIDE] |
| Compound Number | IIA |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C72H72O34 |
| InChI | InChI=1S/2C36H36O17/c2*37-13-23-28(43)32(47)35(53-36-33(48)31(46)29(44)24(52-36)14-49-25(42)10-3-15-1-6-17(38)7-2-15)34(51-23)27-20(41)12-22-26(30(27)45)19(40)11-21(50-22)16-4-8-18(39)9-5-16/h2*1-12,23-24,28-29,31-39,41,43-48H,13-14H2/b2*10-3+/t2*23-,24-,28-,29-,31+,32+,33-,34+,35-,36+/m10/s1 |
| InChIKey | QIZNGJGOVSESRL-QLTOUKIASA-N |
| Literature Reference Author | K.R.MARKHAM,G.J.TANNER,M.CAASI-LIT,M.I.WHITECROSS,M.NAYUDU,K .A.MITCHELL |
| Literature Reference Citation | PHYTOCHEM.,49,1913(1998) |
| Literature Reference DOI | 10.1016/S0031-9422(98)00438-5 |
| Molecular Weight | 1481.343 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWLU742 |