| SpectraBase Compound ID | EYMbDKrHViR |
|---|---|
| InChI | InChI=1S/C35H28O19/c36-11-26-29(47)31(53-33(48)13-4-20(41)27(45)21(42)5-13)32(54-34(49)14-6-22(43)28(46)23(44)7-14)35(52-26)51-25-10-16-18(39)8-15(37)9-24(16)50-30(25)12-1-2-17(38)19(40)3-12/h1-10,26,29,31-32,35-36,47H,11H2,(H9-,37,38,39,40,41,42,43,44,45,46,48,49)/p+1/t26-,29-,31+,32-,35-/m1/s1 |
| InChIKey | AQZBYUZKEFENRX-PGCPAECGSA-O |
| Mol Weight | 753.6 g/mol |
| Molecular Formula | C35H29O19 |
| Exact Mass | 753.130304 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 5ohT6IPGziO |
|---|---|
| Name | CYANIDIN-3-O-(2'',3''-DI-O-GALLOYL-BETA-GLUCOPYRANOSIDE) |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C35H29O19 |
| InChI | InChI=1S/C35H28O19/c36-11-26-29(47)31(53-33(48)13-4-20(41)27(45)21(42)5-13)32(54-34(49)14-6-22(43)28(46)23(44)7-14)35(52-26)51-25-10-16-18(39)8-15(37)9-24(16)50-30(25)12-1-2-17(38)19(40)3-12/h1-10,26,29,31-32,35-36,47H,11H2,(H9-,37,38,39,40,41,42,43,44,45,46,48,49)/p+1/t26-,29-,31+,32-,35-/m1/s1 |
| InChIKey | AQZBYUZKEFENRX-PGCPAECGSA-O |
| Literature Reference Author | T.FOSSEN,O.M.ANDERSEN |
| Literature Reference Citation | PHYTOCHEM.,52,1697(1999) |
| Literature Reference DOI | 10.1016/S0031-9422(99)00188-0 |
| Molecular Weight | 753.604 g/mol |
| Solvent | CD3OD:CF3COOD=19:1 |
| Source File Reference | UWVN337 |