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NICOTIFLORIN
SpectraBase Compound ID 857GXTzt4Q7
InChI InChI=1S/C27H30O15/c1-9-17(31)20(34)22(36)26(39-9)38-8-15-18(32)21(35)23(37)27(41-15)42-25-19(33)16-13(30)6-12(29)7-14(16)40-24(25)10-2-4-11(28)5-3-10/h2-7,9,15,17-18,20-23,26-32,34-37H,8H2,1H3/t9-,15+,17-,18+,20+,21-,22+,23+,26+,27-/m0/s1
InChIKey RTATXGUCZHCSNG-QHWHWDPRSA-N
Mol Weight 594.52 g/mol
Molecular Formula C27H30O15
Exact Mass 594.15847 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ENZSuOPMCEo
Name 5,7,4'-TRIHYDROXYFLAVONE-3-O-RUTINOSYL
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H30O15
InChI InChI=1S/C27H30O15/c1-9-17(31)20(34)22(36)26(39-9)38-8-15-18(32)21(35)23(37)27(41-15)42-25-19(33)16-13(30)6-12(29)7-14(16)40-24(25)10-2-4-11(28)5-3-10/h2-7,9,15,17-18,20-23,26-32,34-37H,8H2,1H3/t9-,15+,17-,18+,20+,21-,22+,23+,26+,27-/m0/s1
InChIKey RTATXGUCZHCSNG-QHWHWDPRSA-N
Literature Reference Author R.SLIMESTAD,O.M.ANDERSEN,G.W.FRANCIS,A.MARSTON,K.HOSTETTMANN
Literature Reference Citation PHYTOCHEM.,40,1537(1995)
Literature Reference DOI 10.1016/0031-9422(95)00383-I
Molecular Weight 594.526 g/mol
Solvent CD3OD
Source File Reference UWMS2925