| SpectraBase Compound ID | IggF4Achj2H |
|---|---|
| InChI | InChI=1S/C30H26O17/c1-10(31)43-9-22-25(40)26(41)28(47-29(42)12-4-18(36)24(39)19(37)5-12)30(46-22)45-21-8-14-15(33)6-13(32)7-20(14)44-27(21)11-2-16(34)23(38)17(35)3-11/h2-8,22,25-26,28,30,40-41H,9H2,1H3,(H7-,32,33,34,35,36,37,38,39,42)/p+1/t22-,25+,26+,28-,30-/m1/s1 |
| InChIKey | QUZHAQRUXCOSEQ-AIHOECDBSA-O |
| Mol Weight | 659.53 g/mol |
| Molecular Formula | C30H27O17 |
| Exact Mass | 659.124824 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GchC4iGVg4a |
|---|---|
| Name | DELPHINIDIN-3-O-(2''-O-GALLOYL-6''-O-ACETYL-BETA-D-GALACTOPYRANOSIDE) |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H27O17 |
| InChI | InChI=1S/C30H26O17/c1-10(31)43-9-22-25(40)26(41)28(47-29(42)12-4-18(36)24(39)19(37)5-12)30(46-22)45-21-8-14-15(33)6-13(32)7-20(14)44-27(21)11-2-16(34)23(38)17(35)3-11/h2-8,22,25-26,28,30,40-41H,9H2,1H3,(H7-,32,33,34,35,36,37,38,39,42)/p+1/t22-,25+,26+,28-,30-/m1/s1 |
| InChIKey | QUZHAQRUXCOSEQ-AIHOECDBSA-O |
| Literature Reference Author | T.FOSSEN,O.M.ANDERSEN |
| Literature Reference Citation | PHYTOCHEM.,46,353(1997) |
| Literature Reference DOI | 10.1016/s0031-9422(97)00293-8 |
| Molecular Weight | 659.534 g/mol |
| Sample ID | 44873 |
| Solvent | CD3OD:CF3COOD=95:5 |