| SpectraBase Compound ID | JgRqIFipumS |
|---|---|
| InChI | InChI=1S/C27H30O17/c1-7-16(32)20(36)22(38)26(41-7)40-6-14-18(34)21(37)23(39)27(43-14)44-25-19(35)15-10(29)4-9(28)5-13(15)42-24(25)8-2-11(30)17(33)12(31)3-8/h2-5,7,14,16,18,20-23,26-34,36-39H,6H2,1H3/t7-,14+,16-,18+,20+,21-,22+,23+,26+,27-/m0/s1 |
| InChIKey | QCIILLDRJZPUDI-PHTGNFSXSA-N |
| Mol Weight | 626.52 g/mol |
| Molecular Formula | C27H30O17 |
| Exact Mass | 626.148299 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DQ3f7vxKcwJ |
|---|---|
| Name | MYRICETIN-3-RUTINOSIDE |
| Compound Number | 14 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H30O17 |
| InChI | InChI=1S/C27H30O17/c1-7-16(32)20(36)22(38)26(41-7)40-6-14-18(34)21(37)23(39)27(43-14)44-25-19(35)15-10(29)4-9(28)5-13(15)42-24(25)8-2-11(30)17(33)12(31)3-8/h2-5,7,14,16,18,20-23,26-34,36-39H,6H2,1H3/t7-,14+,16-,18+,20+,21-,22+,23+,26+,27-/m0/s1 |
| InChIKey | QCIILLDRJZPUDI-PHTGNFSXSA-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 | 626.525 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWLU76350 |