| SpectraBase Compound ID | 4vjAgSTIhKi |
|---|---|
| InChI | InChI=1S/C30H34O17/c1-11(32)42-10-19-22(36)24(38)26(40)29(46-19)47-28-25(39)21(35)18(9-31)45-30(28)44-17-8-15(34)20-14(33)7-16(43-27(20)23(17)37)12-3-5-13(41-2)6-4-12/h3-8,18-19,21-22,24-26,28-31,34-40H,9-10H2,1-2H3/t18-,19-,21-,22-,24-,25+,26-,28-,29+,30-/m0/s1 |
| InChIKey | NXDNDRJNQJPXGJ-HSGALLRGSA-N |
| Mol Weight | 666.6 g/mol |
| Molecular Formula | C30H34O17 |
| Exact Mass | 666.1796 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ECcRNSnFmUb |
|---|---|
| Name | ISOSCUTELLAREIN-4'-METHYLETHER-7-O-(6'''-O-ACETYL)-BETA-ALLOPYRANOSYL-(1'''->2'')-BETA-GLUCOPYRANOSIDE |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H34O17 |
| InChI | InChI=1S/C30H34O17/c1-11(32)42-10-19-22(36)24(38)26(40)29(46-19)47-28-25(39)21(35)18(9-31)45-30(28)44-17-8-15(34)20-14(33)7-16(43-27(20)23(17)37)12-3-5-13(41-2)6-4-12/h3-8,18-19,21-22,24-26,28-31,34-40H,9-10H2,1-2H3/t18-,19-,21-,22-,24-,25+,26-,28-,29+,30-/m0/s1 |
| InChIKey | NXDNDRJNQJPXGJ-HSGALLRGSA-N |
| Literature Reference Author | D.C.ALBACH,R.J.GRAYER,S.R.JENSEN,F.OEZGOEKCE,N.C.VEITCH |
| Literature Reference Citation | PHYTOCHEM.,64,1295(2003) |
| Literature Reference DOI | 10.1016/j.phytochem.2003.08.012 |
| Molecular Weight | 666.590 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWKP5654 |