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(R)-6-HYDROXYMELLEIN-APIOFURANOSYL-(1->6)-BETA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID 8oadxe6CAo2
InChI InChI=1S/C21H28O13/c1-8-2-9-3-10(4-11(23)13(9)18(28)32-8)33-19-16(26)15(25)14(24)12(34-19)5-30-20-17(27)21(29,6-22)7-31-20/h3-4,8,12,14-17,19-20,22-27,29H,2,5-7H2,1H3/t8-,12-,14-,15+,16-,17+,19-,20-,21-/m1/s1
InChIKey TWNQFORIHFYPIZ-CWDJBBCBSA-N
Mol Weight 488.44 g/mol
Molecular Formula C21H28O13
Exact Mass 488.152991 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 43dPm096eSv
Name (R)-6-HYDROXYMELLEIN-APIOFURANOSYL-(1->6)-BETA-D-GLUCOPYRANOSIDE
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H28O13
InChI InChI=1S/C21H28O13/c1-8-2-9-3-10(4-11(23)13(9)18(28)32-8)33-19-16(26)15(25)14(24)12(34-19)5-30-20-17(27)21(29,6-22)7-31-20/h3-4,8,12,14-17,19-20,22-27,29H,2,5-7H2,1H3/t8-,12-,14-,15+,16-,17+,19-,20-,21-/m1/s1
InChIKey TWNQFORIHFYPIZ-CWDJBBCBSA-N
Literature Reference Author T.WARASHINA,Y.NAGATANI,T.NORO
Literature Reference Citation CHEM.PHARM.BULL.,54,14(2006)
Literature Reference DOI 10.1248/cpb.54.14
Molecular Weight 488.446 g/mol
Sample ID 54776
Solvent CD3OD