| SpectraBase Compound ID | 92PiNQ937yh |
|---|---|
| InChI | InChI=1S/C28H32O17/c1-8-17(32)21(36)23(38)27(42-8)41-7-15-19(34)22(37)24(39)28(44-15)45-26-20(35)16-11(30)5-10(29)6-13(16)43-25(26)9-3-12(31)18(33)14(4-9)40-2/h3-6,8,15,17,19,21-24,27-34,36-39H,7H2,1-2H3/t8-,15+,17-,19+,21+,22-,23+,24+,27+,28-/m1/s1 |
| InChIKey | IEPKWJCBNGNVDF-XUPSVBPVSA-N |
| Mol Weight | 640.5 g/mol |
| Molecular Formula | C28H32O17 |
| Exact Mass | 640.16395 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LdCCClcF7tB |
|---|---|
| Name | MYRICETIN-3'-METHYL-3-RUTINOSIDE |
| Compound Number | 13 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H32O17 |
| InChI | InChI=1S/C28H32O17/c1-8-17(32)21(36)23(38)27(42-8)41-7-15-19(34)22(37)24(39)28(44-15)45-26-20(35)16-11(30)5-10(29)6-13(16)43-25(26)9-3-12(31)18(33)14(4-9)40-2/h3-6,8,15,17,19,21-24,27-34,36-39H,7H2,1-2H3/t8-,15+,17-,19+,21+,22-,23+,24+,27+,28-/m1/s1 |
| InChIKey | IEPKWJCBNGNVDF-XUPSVBPVSA-N |
| Literature Reference Author | A.R.BILIA,J.MENDEZ,I.MORELLI |
| Literature Reference Citation | PHARM.ACTA.HELV.,71,191(1996) |
| Literature Reference DOI | 10.1016/0031-6865(96)00010-6 |
| Molecular Weight | 640.552 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWLU76349 |