| SpectraBase Compound ID | DiWBt4SgaXG |
|---|---|
| InChI | InChI=1S/C28H24O16/c29-8-20-23(38)24(39)26(44-27(40)10-3-16(34)22(37)17(35)4-10)28(43-20)42-19-7-12-13(31)5-11(30)6-18(12)41-25(19)9-1-14(32)21(36)15(33)2-9/h1-7,20,23-24,26,28-29,38-39H,8H2,(H7-,30,31,32,33,34,35,36,37,40)/p+1/t20-,23-,24+,26-,28-/m1/s1 |
| InChIKey | DPASDXFUYSHIAA-UIMHPSMTSA-O |
| Mol Weight | 617.49 g/mol |
| Molecular Formula | C28H25O16 |
| Exact Mass | 617.11426 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Io7qRYo1oL8 |
|---|---|
| Name | DELPHINIDIN-3-O-(2''-O-GALLOYL-BETA-D-GALACTOPYRANOSIDE) |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H25O16 |
| InChI | InChI=1S/C28H24O16/c29-8-20-23(38)24(39)26(44-27(40)10-3-16(34)22(37)17(35)4-10)28(43-20)42-19-7-12-13(31)5-11(30)6-18(12)41-25(19)9-1-14(32)21(36)15(33)2-9/h1-7,20,23-24,26,28-29,38-39H,8H2,(H7-,30,31,32,33,34,35,36,37,40)/p+1/t20-,23-,24+,26-,28-/m1/s1 |
| InChIKey | DPASDXFUYSHIAA-UIMHPSMTSA-O |
| Literature Reference Author | D.STRACK,V.WRAY,J.W.METZGER,W.GROSSE |
| Literature Reference Citation | PHYTOCHEM.,31,989(1992) |
| Literature Reference DOI | 10.1016/0031-9422(92)80054-i |
| Molecular Weight | 617.497 g/mol |
| Solvent | CD3OD:DCl |
| Source File Reference | UWVN5007 |