| SpectraBase Compound ID | LwfNtsyO0ow |
|---|---|
| InChI | InChI=1S/C25H24O14/c26-11-6-14(28)12-8-17(24(37-16(12)7-11)10-1-2-13(27)15(29)5-10)38-25-23(35)22(34)21(33)18(39-25)9-36-20(32)4-3-19(30)31/h1-2,5-8,18,21-23,25,33-35H,3-4,9H2,(H4-,26,27,28,29,30,31)/p+1/t18-,21-,22+,23-,25-/m1/s1 |
| InChIKey | MIYGQTFETYBMKF-WVXUANQFSA-O |
| Mol Weight | 549.46 g/mol |
| Molecular Formula | C25H25O14 |
| Exact Mass | 549.12443 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CaBfJf1TQ0T |
|---|---|
| Name | CYANIDIN-3-O-(6''-O-SUCCINYL-BETA-GLUCOPYRANOSIDE) |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C25H25O14 |
| InChI | InChI=1S/C25H24O14/c26-11-6-14(28)12-8-17(24(37-16(12)7-11)10-1-2-13(27)15(29)5-10)38-25-23(35)22(34)21(33)18(39-25)9-36-20(32)4-3-19(30)31/h1-2,5-8,18,21-23,25,33-35H,3-4,9H2,(H4-,26,27,28,29,30,31)/p+1/t18-,21-,22+,23-,25-/m1/s1 |
| InChIKey | MIYGQTFETYBMKF-WVXUANQFSA-O |
| Literature Reference Author | T.FOSSEN,O.M.ANDERSEN |
| Literature Reference Citation | PHYTOCHEM.,49,1065(1998) |
| Literature Reference DOI | 10.1016/S0031-9422(98)00064-8 |
| Molecular Weight | 549.465 g/mol |
| Solvent | CD3OD:CF3COOD=95:5 |
| Source File Reference | UWLU389 |