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RUBIAYANONE-A;1,4-DIHYDROXYANTHRAQUINONE-2-O-BETA-D-XYLOPYRANOSYL-(1->6)-BETA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID K9DKie3nVjE
InChI InChI=1S/C25H26O14/c26-10-5-12(19(31)15-14(10)16(28)8-3-1-2-4-9(8)17(15)29)38-25-23(35)21(33)20(32)13(39-25)7-37-24-22(34)18(30)11(27)6-36-24/h1-5,11,13,18,20-27,30-35H,6-7H2/t11-,13-,18+,20-,21+,22-,23-,24+,25-/m1/s1
InChIKey DDRYMWKSIFOIRW-SSZNVGDCSA-N
Mol Weight 550.47 g/mol
Molecular Formula C25H26O14
Exact Mass 550.132256 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 52JUC9jelbh
Name RUBIAYANONE-A;1,4-DIHYDROXYANTHRAQUINONE-2-O-BETA-D-XYLOPYRANOSYL-(1->6)-BETA-D-GLUCOPYRANOSIDE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H26O14
InChI InChI=1S/C25H26O14/c26-10-5-12(19(31)15-14(10)16(28)8-3-1-2-4-9(8)17(15)29)38-25-23(35)21(33)20(32)13(39-25)7-37-24-22(34)18(30)11(27)6-36-24/h1-5,11,13,18,20-27,30-35H,6-7H2/t11-,13-,18+,20-,21+,22-,23-,24+,25-/m1/s1
InChIKey DDRYMWKSIFOIRW-SSZNVGDCSA-N
Literature Reference Author M.J.LIOU,C.M.TENG,T.S.WU
Literature Reference Citation J.CHIN.CHEM.SOC.,49,1025(2002)
Literature Reference DOI 10.1002/jccs.200200146
Molecular Weight 550.473 g/mol
Solvent DMSO-D6
Source File Reference UWMS3466