| SpectraBase Compound ID | 9RowuXU323F |
|---|---|
| InChI | InChI=1S/C27H30O16/c28-7-17-19(33)21(35)23(37)26(42-17)40-15-5-10(30)4-14-11(15)6-16(25(39-14)9-1-2-12(31)13(32)3-9)41-27-24(38)22(36)20(34)18(8-29)43-27/h1-6,17-24,26-29,33-38H,7-8H2,(H2-,30,31,32)/p+1/t17-,18-,19-,20-,21+,22+,23-,24-,26-,27-/m0/s1 |
| InChIKey | RDFLLVCQYHQOBU-ZVZNDBOMSA-O |
| Mol Weight | 611.53 g/mol |
| Molecular Formula | C27H31O16 |
| Exact Mass | 611.16121 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | pJyCkoT1FD |
|---|---|
| Name | CYANIDIN-3,5-DI-O-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 7 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H31O16 |
| InChI | InChI=1S/C27H30O16/c28-7-17-19(33)21(35)23(37)26(42-17)40-15-5-10(30)4-14-11(15)6-16(25(39-14)9-1-2-12(31)13(32)3-9)41-27-24(38)22(36)20(34)18(8-29)43-27/h1-6,17-24,26-29,33-38H,7-8H2,(H2-,30,31,32)/p+1/t17-,18-,19-,20-,21+,22+,23-,24-,26-,27-/m0/s1 |
| InChIKey | RDFLLVCQYHQOBU-ZVZNDBOMSA-O |
| Literature Reference Author | T.MAS,J.SUSPERREGUI,B.BERKE,C.CHEZE,S.MOREAU,A.NUHRICH,J.VER CAUTEREN |
| Literature Reference Citation | PHYTOCHEM.,53,679(2000) |
| Literature Reference DOI | 10.1016/S0031-9422(99)00619-6 |
| Molecular Weight | 611.534 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWLU2099 |