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KAEMPFEROL-3-O-BETA-D-GLUCOPYRANOSIDE-6''-(3-HYDROXY-3-METHYL-GLUTARATE)
SpectraBase Compound ID 5zVaKfIZBaP
InChI InChI=1S/C27H28O15/c1-27(38,8-17(31)32)9-18(33)39-10-16-20(34)22(36)23(37)26(41-16)42-25-21(35)19-14(30)6-13(29)7-15(19)40-24(25)11-2-4-12(28)5-3-11/h2-7,16,20,22-23,26,28-30,34,36-38H,8-10H2,1H3,(H,31,32)/t16-,20-,22+,23-,26+,27?/m1/s1
InChIKey ZALWWUJLKFBCQF-ZKZRXTDRSA-N
Mol Weight 592.51 g/mol
Molecular Formula C27H28O15
Exact Mass 592.14282 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LuIYLaLiNL9
Name KAEMPFEROL-3-O-[6''-O-(3-HYDROXY-3-METHYLGLUTAROYL)-GLUCOPYRANOSIDE]
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H28O15
InChI InChI=1S/C27H28O15/c1-27(38,8-17(31)32)9-18(33)39-10-16-20(34)22(36)23(37)26(41-16)42-25-21(35)19-14(30)6-13(29)7-15(19)40-24(25)11-2-4-12(28)5-3-11/h2-7,16,20,22-23,26,28-30,34,36-38H,8-10H2,1H3,(H,31,32)/t16-,20-,22+,23-,26+,27?/m1/s1
InChIKey ZALWWUJLKFBCQF-ZKZRXTDRSA-N
Literature Reference Author K.Y.JUNG,J.C.DO,K.H.SON
Literature Reference Citation PHYTOCHEM.,34,1196(1993)
Literature Reference DOI 10.1016/S0031-9422(00)90747-7
Molecular Weight 592.510 g/mol
Solvent DMSO-D6
Source File Reference UWVN6606