| SpectraBase Compound ID | KNMgQfrfOkX |
|---|---|
| InChI | InChI=1S/C27H30O16/c1-8-15(30)20(35)22(37)26(40-8)39-7-13-17(32)21(36)23(38)27(42-13)43-25-19(34)14-12(6-11(29)16(31)18(14)33)41-24(25)9-2-4-10(28)5-3-9/h2-6,8,13,15,17,20-23,26-33,35-38H,7H2,1H3/t8-,13-,15-,17+,20+,21+,22-,23-,26+,27-/m0/s1 |
| InChIKey | QYRJNVCANQPMCH-WRVMOQFISA-N |
| Mol Weight | 610.52 g/mol |
| Molecular Formula | C27H30O16 |
| Exact Mass | 610.153385 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4ANkGZarVOF |
|---|---|
| Name | 5,6,7,4'-TETRAHYDROXYFLAVONOL-3-O-RUTINOSIDE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H30O16 |
| InChI | InChI=1S/C27H30O16/c1-8-15(30)20(35)22(37)26(40-8)39-7-13-17(32)21(36)23(38)27(42-13)43-25-19(34)14-12(6-11(29)16(31)18(14)33)41-24(25)9-2-4-10(28)5-3-9/h2-6,8,13,15,17,20-23,26-33,35-38H,7H2,1H3/t8-,13-,15-,17+,20+,21+,22-,23-,26+,27-/m0/s1 |
| InChIKey | QYRJNVCANQPMCH-WRVMOQFISA-N |
| Literature Reference Author | E.J.C.GAMEZ,L.LUYENGI,S.K.LEE,L.F.ZHU,B.N.ZHOU,H.H.S.FONG,J. M.PEZZUTO,A.D.KINGHO |
| Literature Reference Citation | J.NAT.PROD.,61,706(1998) |
| Literature Reference DOI | 10.1021/np9800203 |
| Molecular Weight | 610.526 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWMZ37 |